{"id":"https://openalex.org/W4415522702","doi":"https://doi.org/10.1007/s10822-025-00688-z","title":"Investigating the ameliorative effect of Kalanchoe pinnata on neuroinflammation-associated Alzheimer\u2019s disease using network pharmacology, molecular docking, and in vitro studies","display_name":"Investigating the ameliorative effect of Kalanchoe pinnata on neuroinflammation-associated Alzheimer\u2019s disease using network pharmacology, molecular docking, and in vitro studies","publication_year":2025,"publication_date":"2025-10-24","ids":{"openalex":"https://openalex.org/W4415522702","doi":"https://doi.org/10.1007/s10822-025-00688-z","pmid":"https://pubmed.ncbi.nlm.nih.gov/41136693"},"language":"en","primary_location":{"id":"doi:10.1007/s10822-025-00688-z","doi":"https://doi.org/10.1007/s10822-025-00688-z","is_oa":false,"landing_page_url":"https://doi.org/10.1007/s10822-025-00688-z","pdf_url":null,"source":{"id":"https://openalex.org/S64621741","display_name":"Journal of Computer-Aided Molecular Design","issn_l":"0920-654X","issn":["0920-654X","1573-4951"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","doyens","jufo-1","medline","norway-1","poland-70","russia-white-list-1"],"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computer-Aided Molecular Design","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","pubmed"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5060711424","display_name":"Pratima Khandayataray","orcid":"https://orcid.org/0000-0002-2808-0132","observed_orcids":["https://orcid.org/0000-0002-2808-0132"]},"institutions":[{"id":"https://openalex.org/I70699430","display_name":"Utkal University","ror":"https://ror.org/0034eez47","country_code":"IN","type":"education","lineage":["https://openalex.org/I70699430"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"Pratima Khandayataray","raw_affiliation_strings":["Department of Biotechnology, Academy of Management and Information Technology, Utkal University, Bhubaneswar, Odisha, 752057, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Biotechnology, Academy of Management and Information Technology, Utkal University, Bhubaneswar, Odisha, 752057, India","institution_ids":["https://openalex.org/I70699430"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5058909106","display_name":"Meesala Krishna Murthy","orcid":"https://orcid.org/0000-0002-3634-0053","observed_orcids":["https://orcid.org/0000-0002-3634-0053"]},"institutions":[{"id":"https://openalex.org/I74319210","display_name":"Chitkara University","ror":"https://ror.org/057d6z539","country_code":"IN","type":"education","lineage":["https://openalex.org/I74319210"]}],"countries":["IN"],"is_corresponding":true,"raw_author_name":"Meesala Krishna Murthy","raw_affiliation_strings":["Department of Allied Health Sciences, Chitkara School of Health Sciences, Chitkara University, Rajpura, Punjab, 140401, India. krishnameesala6@gmail.com","Department of Allied Health Sciences, Chitkara School of Health Sciences, Chitkara University, Rajpura, Punjab, 140401, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Allied Health Sciences, Chitkara School of Health Sciences, Chitkara University, Rajpura, Punjab, 140401, India. krishnameesala6@gmail.com","institution_ids":["https://openalex.org/I74319210"]},{"raw_affiliation_string":"Department of Allied Health Sciences, Chitkara School of Health Sciences, Chitkara University, Rajpura, Punjab, 140401, India","institution_ids":["https://openalex.org/I74319210"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5058909106"],"corresponding_institution_ids":["https://openalex.org/I74319210"],"apc_list":{"value":4190,"currency":"USD","value_usd":4190},"apc_paid":null,"fwci":2.9596,"has_fulltext":false,"cited_by_count":3,"citation_normalized_percentile":{"value":0.88213089,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":96,"max":97},"biblio":{"volume":"39","issue":"2","first_page":"105","last_page":"105"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T12891","display_name":"Medicinal Plants and Neuroprotection","score":0.5952000021934509,"subfield":{"id":"https://openalex.org/subfields/2707","display_name":"Complementary and alternative medicine"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},"topics":[{"id":"https://openalex.org/T12891","display_name":"Medicinal Plants and Neuroprotection","score":0.5952000021934509,"subfield":{"id":"https://openalex.org/subfields/2707","display_name":"Complementary and alternative medicine"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},{"id":"https://openalex.org/T10086","display_name":"Alzheimer's disease research and treatments","score":0.3910999894142151,"subfield":{"id":"https://openalex.org/subfields/2804","display_name":"Cellular and Molecular Neuroscience"},"field":{"id":"https://openalex.org/fields/28","display_name":"Neuroscience"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T11266","display_name":"Neuroinflammation and Neurodegeneration Mechanisms","score":0.006300000008195639,"subfield":{"id":"https://openalex.org/subfields/2808","display_name":"Neurology"},"field":{"id":"https://openalex.org/fields/28","display_name":"Neuroscience"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/kalanchoe-pinnata","display_name":"Kalanchoe pinnata","score":1.0},{"id":"https://openalex.org/keywords/alzheimer-s-disease","display_name":"Alzheimer's disease","score":0.9990000128746033},{"id":"https://openalex.org/keywords/neuroinflammation","display_name":"neuroinflammation","score":0.9980000257492065},{"id":"https://openalex.org/keywords/neuroprotection","display_name":"neuroprotection","score":0.8360000252723694},{"id":"https://openalex.org/keywords/amyloid-beta-aggregation","display_name":"amyloid-beta aggregation","score":0.9739999771118164},{"id":"https://openalex.org/keywords/kaempferol","display_name":"kaempferol","score":0.9990000128746033},{"id":"https://openalex.org/keywords/quercetin","display_name":"quercetin","score":1.0},{"id":"https://openalex.org/keywords/pi3k-akt-signaling","display_name":"PI3K/Akt signaling","score":0.9470000267028809},{"id":"https://openalex.org/keywords/camp-signaling","display_name":"cAMP signaling","score":0.9980000257492065},{"id":"https://openalex.org/keywords/microglia","display_name":"microglia","score":0.8169999718666077},{"id":"https://openalex.org/keywords/antioxidant-activity","display_name":"antioxidant activity","score":0.6790000200271606},{"id":"https://openalex.org/keywords/multi-target-drugs","display_name":"multi-target drugs","score":0.5669999718666077}],"concepts":[{"id":"https://openalex.org/C2778394261","wikidata":"https://www.wikidata.org/wiki/Q312063","display_name":"Kalanchoe","level":2,"score":0.798799991607666},{"id":"https://openalex.org/C2779221052","wikidata":"https://www.wikidata.org/wiki/Q155938","display_name":"Crassulaceae","level":2,"score":0.7720999717712402},{"id":"https://openalex.org/C202751555","wikidata":"https://www.wikidata.org/wiki/Q221681","display_name":"In vitro","level":2,"score":0.6449999809265137},{"id":"https://openalex.org/C25498285","wikidata":"https://www.wikidata.org/wiki/Q1981368","display_name":"Neuroprotection","level":2,"score":0.6312000155448914},{"id":"https://openalex.org/C98274493","wikidata":"https://www.wikidata.org/wiki/Q128406","display_name":"Pharmacology","level":1,"score":0.566100001335144},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.4693000018596649},{"id":"https://openalex.org/C2778004101","wikidata":"https://www.wikidata.org/wiki/Q133948","display_name":"Antioxidant","level":2,"score":0.4426000118255615},{"id":"https://openalex.org/C556039675","wikidata":"https://www.wikidata.org/wiki/Q771035","display_name":"Traditional medicine","level":1,"score":0.4374000132083893},{"id":"https://openalex.org/C33618052","wikidata":"https://www.wikidata.org/wiki/Q6013136","display_name":"In vitro toxicology","level":3,"score":0.39660000801086426},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.38760000467300415},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.3824999928474426},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.3544999957084656},{"id":"https://openalex.org/C2779134260","wikidata":"https://www.wikidata.org/wiki/Q12136","display_name":"Disease","level":2,"score":0.29580000042915344},{"id":"https://openalex.org/C2780876136","wikidata":"https://www.wikidata.org/wiki/Q900986","display_name":"Schisandra chinensis","level":4,"score":0.29170000553131104},{"id":"https://openalex.org/C2779158651","wikidata":"https://www.wikidata.org/wiki/Q188840","display_name":"Medicinal plants","level":2,"score":0.2777000069618225},{"id":"https://openalex.org/C2780751074","wikidata":"https://www.wikidata.org/wiki/Q7189797","display_name":"Phytomedicine","level":2,"score":0.2743000090122223},{"id":"https://openalex.org/C62478195","wikidata":"https://www.wikidata.org/wiki/Q828130","display_name":"Signal transduction","level":2,"score":0.2721000015735626},{"id":"https://openalex.org/C116073593","wikidata":"https://www.wikidata.org/wiki/Q864491","display_name":"Biological activity","level":3,"score":0.26980000734329224}],"mesh":[{"descriptor_ui":"D000091484","descriptor_name":"Network Pharmacology","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000544","descriptor_name":"Alzheimer Disease","qualifier_ui":"Q000188","qualifier_name":"drug therapy","is_major_topic":true},{"descriptor_ui":"D000544","descriptor_name":"Alzheimer Disease","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":true},{"descriptor_ui":"D000544","descriptor_name":"Alzheimer Disease","qualifier_ui":"Q000473","qualifier_name":"pathology","is_major_topic":true},{"descriptor_ui":"D000818","descriptor_name":"Animals","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000975","descriptor_name":"Antioxidants","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D000975","descriptor_name":"Antioxidants","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D002460","descriptor_name":"Cell Line","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D010936","descriptor_name":"Plant Extracts","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D010936","descriptor_name":"Plant Extracts","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D015398","descriptor_name":"Signal Transduction","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D016207","descriptor_name":"Cytokines","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D016229","descriptor_name":"Amyloid beta-Peptides","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D017628","descriptor_name":"Microglia","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":false},{"descriptor_ui":"D017628","descriptor_name":"Microglia","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D018696","descriptor_name":"Neuroprotective Agents","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D018696","descriptor_name":"Neuroprotective Agents","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D019869","descriptor_name":"Phosphatidylinositol 3-Kinases","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D031962","descriptor_name":"Kalanchoe","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D051057","descriptor_name":"Proto-Oncogene Proteins c-akt","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D051379","descriptor_name":"Mice","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1007/s10822-025-00688-z","doi":"https://doi.org/10.1007/s10822-025-00688-z","is_oa":false,"landing_page_url":"https://doi.org/10.1007/s10822-025-00688-z","pdf_url":null,"source":{"id":"https://openalex.org/S64621741","display_name":"Journal of Computer-Aided Molecular Design","issn_l":"0920-654X","issn":["0920-654X","1573-4951"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","doyens","jufo-1","medline","norway-1","poland-70","russia-white-list-1"],"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computer-Aided Molecular Design","raw_type":"journal-article"},{"id":"pmid:41136693","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/41136693","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of computer-aided molecular design","raw_type":"Journal Article"}],"best_oa_location":null,"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/3","score":0.9922999739646912,"display_name":"Good health and well-being"}],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":121,"referenced_works":["https://openalex.org/W333643404","https://openalex.org/W978308701","https://openalex.org/W1558509021","https://openalex.org/W1570513132","https://openalex.org/W1743841615","https://openalex.org/W1970164987","https://openalex.org/W1974198922","https://openalex.org/W1975711804","https://openalex.org/W1982795519","https://openalex.org/W1983816589","https://openalex.org/W1987444426","https://openalex.org/W1988772292","https://openalex.org/W1995206450","https://openalex.org/W1999693897","https://openalex.org/W2005720379","https://openalex.org/W2009792683","https://openalex.org/W2011361113","https://openalex.org/W2014388728","https://openalex.org/W2033588393","https://openalex.org/W2033591223","https://openalex.org/W2034986487","https://openalex.org/W2037388137","https://openalex.org/W2039766379","https://openalex.org/W2041183431","https://openalex.org/W2046919174","https://openalex.org/W2058645214","https://openalex.org/W2069705491","https://openalex.org/W2075361934","https://openalex.org/W2084972185","https://openalex.org/W2088066151","https://openalex.org/W2099249066","https://openalex.org/W2103440561","https://openalex.org/W2112896415","https://openalex.org/W2114918609","https://openalex.org/W2118867129","https://openalex.org/W2119810088","https://openalex.org/W2123619340","https://openalex.org/W2133801172","https://openalex.org/W2140607486","https://openalex.org/W2149848093","https://openalex.org/W2152630148","https://openalex.org/W2153206087","https://openalex.org/W2153284686","https://openalex.org/W2162151166","https://openalex.org/W2163257631","https://openalex.org/W2182271449","https://openalex.org/W2229830115","https://openalex.org/W2301590396","https://openalex.org/W2401755963","https://openalex.org/W2416778334","https://openalex.org/W2474747771","https://openalex.org/W2537679995","https://openalex.org/W2593436234","https://openalex.org/W2594725981","https://openalex.org/W2749236647","https://openalex.org/W2783371055","https://openalex.org/W2801088198","https://openalex.org/W2809863685","https://openalex.org/W2898390889","https://openalex.org/W2904542223","https://openalex.org/W2909401811","https://openalex.org/W2913008171","https://openalex.org/W2913545809","https://openalex.org/W2937074474","https://openalex.org/W2947174993","https://openalex.org/W2949305189","https://openalex.org/W2955341169","https://openalex.org/W2956226065","https://openalex.org/W2960505072","https://openalex.org/W2976163884","https://openalex.org/W2981132553","https://openalex.org/W2981643522","https://openalex.org/W2994430267","https://openalex.org/W2997022986","https://openalex.org/W3006197455","https://openalex.org/W3018693245","https://openalex.org/W3092829183","https://openalex.org/W3095197320","https://openalex.org/W3097145107","https://openalex.org/W3097527510","https://openalex.org/W3112948680","https://openalex.org/W3118335066","https://openalex.org/W3136980102","https://openalex.org/W3146405454","https://openalex.org/W3148286855","https://openalex.org/W3152069561","https://openalex.org/W3156764549","https://openalex.org/W3161394841","https://openalex.org/W3174076494","https://openalex.org/W3176962211","https://openalex.org/W3183776843","https://openalex.org/W3200220429","https://openalex.org/W4210916648","https://openalex.org/W4211036635","https://openalex.org/W4211238543","https://openalex.org/W4213370488","https://openalex.org/W4281664373","https://openalex.org/W4281717038","https://openalex.org/W4282913408","https://openalex.org/W4285132881","https://openalex.org/W4285741728","https://openalex.org/W4288940963","https://openalex.org/W4316494517","https://openalex.org/W4318275375","https://openalex.org/W4321608062","https://openalex.org/W4385896873","https://openalex.org/W4387472606","https://openalex.org/W4388297509","https://openalex.org/W4390561650","https://openalex.org/W4391845047","https://openalex.org/W4392763015","https://openalex.org/W4395085030","https://openalex.org/W4395117050","https://openalex.org/W4398209589","https://openalex.org/W4398793995","https://openalex.org/W4399474345","https://openalex.org/W4400450591","https://openalex.org/W4401851319","https://openalex.org/W4406063397","https://openalex.org/W4406196894","https://openalex.org/W4411413523"],"related_works":["https://openalex.org/W7162781129","https://openalex.org/W7163073091","https://openalex.org/W7204494418","https://openalex.org/W7134134369","https://openalex.org/W4404646401","https://openalex.org/W7125784451","https://openalex.org/W4311702765","https://openalex.org/W2986367420","https://openalex.org/W4413959021","https://openalex.org/W7144341284"],"abstract_inverted_index":null,"counts_by_year":[{"year":2026,"cited_by_count":3}],"updated_date":"2026-11-12T12:28:57.059296","created_date":"2025-10-24T00:00:00"}