{"id":"https://openalex.org/W4416848824","doi":"https://doi.org/10.1134/s1068162025600205","title":"Heterocyclic Coumarin Derivatives as Multifunctional Biosafe Candidates: Bridging Synthetic Chemistry with In Vitro and In Silico Evaluations","display_name":"Heterocyclic Coumarin Derivatives as Multifunctional Biosafe Candidates: Bridging Synthetic Chemistry with In Vitro and In Silico Evaluations","publication_year":2025,"publication_date":"2025-12-01","ids":{"openalex":"https://openalex.org/W4416848824","doi":"https://doi.org/10.1134/s1068162025600205"},"language":"en","primary_location":{"id":"doi:10.1134/s1068162025600205","doi":"https://doi.org/10.1134/s1068162025600205","is_oa":false,"landing_page_url":"https://doi.org/10.1134/s1068162025600205","pdf_url":null,"source":{"id":"https://openalex.org/S68845364","display_name":"Russian Journal of Bioorganic Chemistry","issn_l":"1068-1620","issn":["1068-1620","1573-9163","1608-330X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","norway-1","poland-40","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320267","host_organization_name":"Pleiades Publishing","host_organization_lineage":["https://openalex.org/P4310320267","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Pleiades Publishing","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Russian Journal of Bioorganic Chemistry","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref"],"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/A5058363870","display_name":"Nameer Mazin Zeki","orcid":"https://orcid.org/0000-0001-5457-7268","observed_orcids":["https://orcid.org/0000-0001-5457-7268"]},"institutions":[{"id":"https://openalex.org/I4405259204","display_name":"Ninevah University","ror":"https://ror.org/01x7tft50","country_code":"IQ","type":"education","lineage":["https://openalex.org/I4405259204"]}],"countries":["IQ"],"is_corresponding":false,"raw_author_name":"Nameer Mazin Zeki","raw_affiliation_strings":["Department of Pharmacology, College of Medicine, Ninevah University, 41001, Mosul, Iraq"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Pharmacology, College of Medicine, Ninevah University, 41001, Mosul, Iraq","institution_ids":["https://openalex.org/I4405259204"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5019817672","display_name":"Yasser Fakri Mustafa","orcid":"https://orcid.org/0000-0002-0926-7428","observed_orcids":["https://orcid.org/0000-0002-0926-7428"]},"institutions":[{"id":"https://openalex.org/I12150220","display_name":"University of Mosul","ror":"https://ror.org/039cf4q47","country_code":"IQ","type":"education","lineage":["https://openalex.org/I12150220"]}],"countries":["IQ"],"is_corresponding":true,"raw_author_name":"Yasser Fakri Mustafa","raw_affiliation_strings":["Department of Pharmaceutical Chemistry, College of Pharmacy, University of Mosul, 41001, Mosul, Iraq"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Pharmaceutical Chemistry, College of Pharmacy, University of Mosul, 41001, Mosul, Iraq","institution_ids":["https://openalex.org/I12150220"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5094263233","display_name":"Rana Naeem Jibroo","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I12150220","display_name":"University of Mosul","ror":"https://ror.org/039cf4q47","country_code":"IQ","type":"education","lineage":["https://openalex.org/I12150220"]}],"countries":["IQ"],"is_corresponding":false,"raw_author_name":"Rana Naeem Jibroo","raw_affiliation_strings":["Department of Pharmaceutical Chemistry, College of Pharmacy, University of Mosul, 41001, Mosul, Iraq"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Pharmaceutical Chemistry, College of Pharmacy, University of Mosul, 41001, Mosul, Iraq","institution_ids":["https://openalex.org/I12150220"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5019817672"],"corresponding_institution_ids":["https://openalex.org/I12150220"],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.0,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"51","issue":"6","first_page":"2482","last_page":"2507"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10274","display_name":"Heterocyclic Compound Synthesis and Bioactivity","score":0.9990000128746033,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10274","display_name":"Heterocyclic Compound Synthesis and Bioactivity","score":0.9990000128746033,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T14099","display_name":"Synthesis and Characterization of Heterocyclic Compounds","score":0.0003000000142492354,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T13023","display_name":"Synthesis of Organic Compounds","score":0.0003000000142492354,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/coumarins","display_name":"coumarins","score":0.9959999918937683},{"id":"https://openalex.org/keywords/five-membered-heterocycles","display_name":"five-membered heterocycles","score":0.8989999890327454},{"id":"https://openalex.org/keywords/antiproliferative-activity","display_name":"antiproliferative activity","score":0.9409999847412109},{"id":"https://openalex.org/keywords/antioxidant-activity","display_name":"antioxidant activity","score":0.9909999966621399},{"id":"https://openalex.org/keywords/antidiabetic-drugs","display_name":"antidiabetic drugs","score":0.8600000143051147},{"id":"https://openalex.org/keywords/glucosidase-inhibition","display_name":"glucosidase inhibition","score":0.843999981880188},{"id":"https://openalex.org/keywords/amylase-inhibition","display_name":"amylase inhibition","score":0.9710000157356262},{"id":"https://openalex.org/keywords/anti-inflammatory-activity","display_name":"anti-inflammatory activity","score":0.9819999933242798},{"id":"https://openalex.org/keywords/lipoxygenase-pathway","display_name":"lipoxygenase pathway","score":0.9169999957084656},{"id":"https://openalex.org/keywords/antifungal-activity","display_name":"antifungal activity","score":0.9819999933242798},{"id":"https://openalex.org/keywords/antibacterial-activity","display_name":"antibacterial activity","score":0.9879999756813049},{"id":"https://openalex.org/keywords/biosafety","display_name":"biosafety","score":0.765999972820282},{"id":"https://openalex.org/keywords/oral-bioavailability","display_name":"oral bioavailability","score":0.7390000224113464},{"id":"https://openalex.org/keywords/toxicity-assessment","display_name":"toxicity prediction","score":0.734000027179718},{"id":"https://openalex.org/keywords/pharmacokinetics","display_name":"pharmacokinetics","score":0.49900001287460327}],"concepts":[{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.8004999756813049},{"id":"https://openalex.org/C2781338262","wikidata":"https://www.wikidata.org/wiki/Q111812","display_name":"Coumarin","level":2,"score":0.7635999917984009},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.7402999997138977},{"id":"https://openalex.org/C52384281","wikidata":"https://www.wikidata.org/wiki/Q864713","display_name":"Biosafety","level":2,"score":0.694100022315979},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.6276000142097473},{"id":"https://openalex.org/C2779548794","wikidata":"https://www.wikidata.org/wiki/Q578726","display_name":"Antifungal","level":2,"score":0.4796999990940094},{"id":"https://openalex.org/C2779321679","wikidata":"https://www.wikidata.org/wiki/Q207722","display_name":"Pyrimidine","level":2,"score":0.4440000057220459},{"id":"https://openalex.org/C202751555","wikidata":"https://www.wikidata.org/wiki/Q221681","display_name":"In vitro","level":2,"score":0.4415000081062317},{"id":"https://openalex.org/C2778512257","wikidata":"https://www.wikidata.org/wiki/Q256602","display_name":"Ciprofloxacin","level":3,"score":0.4047999978065491},{"id":"https://openalex.org/C181389837","wikidata":"https://www.wikidata.org/wiki/Q461809","display_name":"Bioavailability","level":2,"score":0.39559999108314514},{"id":"https://openalex.org/C41847442","wikidata":"https://www.wikidata.org/wiki/Q916723","display_name":"Lipinski's rule of five","level":4,"score":0.37059998512268066},{"id":"https://openalex.org/C4937899","wikidata":"https://www.wikidata.org/wiki/Q68541106","display_name":"Antimicrobial","level":2,"score":0.3702000081539154},{"id":"https://openalex.org/C113253001","wikidata":"https://www.wikidata.org/wiki/Q864640","display_name":"Bioorganic chemistry","level":3,"score":0.34290000796318054},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.3109000027179718},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.30079999566078186},{"id":"https://openalex.org/C2776309666","wikidata":"https://www.wikidata.org/wiki/Q408384","display_name":"Quinoline","level":2,"score":0.2856999933719635},{"id":"https://openalex.org/C69610077","wikidata":"https://www.wikidata.org/wiki/Q912270","display_name":"Click chemistry","level":2,"score":0.2680000066757202},{"id":"https://openalex.org/C114373084","wikidata":"https://www.wikidata.org/wiki/Q273499","display_name":"Chemical synthesis","level":3,"score":0.26579999923706055},{"id":"https://openalex.org/C171250308","wikidata":"https://www.wikidata.org/wiki/Q11468","display_name":"Nanotechnology","level":1,"score":0.2648000121116638},{"id":"https://openalex.org/C193042331","wikidata":"https://www.wikidata.org/wiki/Q1772003","display_name":"Structure\u2013activity relationship","level":3,"score":0.263700008392334},{"id":"https://openalex.org/C2777752112","wikidata":"https://www.wikidata.org/wiki/Q903238","display_name":"Lead compound","level":3,"score":0.2614000141620636}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1134/s1068162025600205","doi":"https://doi.org/10.1134/s1068162025600205","is_oa":false,"landing_page_url":"https://doi.org/10.1134/s1068162025600205","pdf_url":null,"source":{"id":"https://openalex.org/S68845364","display_name":"Russian Journal of Bioorganic Chemistry","issn_l":"1068-1620","issn":["1068-1620","1573-9163","1608-330X"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","norway-1","poland-40","russia-white-list-2"],"host_organization":"https://openalex.org/P4310320267","host_organization_name":"Pleiades Publishing","host_organization_lineage":["https://openalex.org/P4310320267","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Pleiades Publishing","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Russian Journal of Bioorganic Chemistry","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[{"display_name":"Good health and well-being","score":0.9537000060081482,"id":"https://metadata.un.org/sdg/3"}],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":92,"referenced_works":["https://openalex.org/W1948791258","https://openalex.org/W1995793150","https://openalex.org/W2033120249","https://openalex.org/W2070697777","https://openalex.org/W2078927320","https://openalex.org/W2080447388","https://openalex.org/W2097688080","https://openalex.org/W2120884178","https://openalex.org/W2169987054","https://openalex.org/W2379628571","https://openalex.org/W2569323818","https://openalex.org/W2886516169","https://openalex.org/W2889236896","https://openalex.org/W2943611817","https://openalex.org/W2946891612","https://openalex.org/W2995275380","https://openalex.org/W3014869132","https://openalex.org/W3015800818","https://openalex.org/W3016982200","https://openalex.org/W3018584379","https://openalex.org/W3024824713","https://openalex.org/W3025264817","https://openalex.org/W3038092112","https://openalex.org/W3081435180","https://openalex.org/W3089890743","https://openalex.org/W3106906779","https://openalex.org/W3114609148","https://openalex.org/W3135152601","https://openalex.org/W3135722454","https://openalex.org/W3162071347","https://openalex.org/W3169622368","https://openalex.org/W3182000940","https://openalex.org/W3195148374","https://openalex.org/W3197030475","https://openalex.org/W4206342735","https://openalex.org/W4206483535","https://openalex.org/W4220780322","https://openalex.org/W4229004224","https://openalex.org/W4229019249","https://openalex.org/W4229022016","https://openalex.org/W4229045912","https://openalex.org/W4229045988","https://openalex.org/W4229056587","https://openalex.org/W4251844152","https://openalex.org/W4280488703","https://openalex.org/W4281973265","https://openalex.org/W4282040087","https://openalex.org/W4282048832","https://openalex.org/W4283766083","https://openalex.org/W4286214906","https://openalex.org/W4293879715","https://openalex.org/W4294869784","https://openalex.org/W4308035785","https://openalex.org/W4310077815","https://openalex.org/W4313392597","https://openalex.org/W4317743243","https://openalex.org/W4318934724","https://openalex.org/W4323363178","https://openalex.org/W4324026107","https://openalex.org/W4360980446","https://openalex.org/W4362717085","https://openalex.org/W4366771975","https://openalex.org/W4367692945","https://openalex.org/W4381336052","https://openalex.org/W4385237488","https://openalex.org/W4385445592","https://openalex.org/W4385690952","https://openalex.org/W4385892633","https://openalex.org/W4386256161","https://openalex.org/W4386750708","https://openalex.org/W4387363776","https://openalex.org/W4387451348","https://openalex.org/W4387845841","https://openalex.org/W4388152666","https://openalex.org/W4390196404","https://openalex.org/W4390233693","https://openalex.org/W4390471488","https://openalex.org/W4390502969","https://openalex.org/W4390655823","https://openalex.org/W4390937215","https://openalex.org/W4391100466","https://openalex.org/W4391669385","https://openalex.org/W4391776188","https://openalex.org/W4392190379","https://openalex.org/W4392597434","https://openalex.org/W4393236849","https://openalex.org/W4393341442","https://openalex.org/W4393343949","https://openalex.org/W4394984885","https://openalex.org/W4395010444","https://openalex.org/W4401620575","https://openalex.org/W4402073102"],"related_works":["https://openalex.org/W4409970003","https://openalex.org/W4395111343","https://openalex.org/W7125597174","https://openalex.org/W4401620575","https://openalex.org/W3176321558","https://openalex.org/W6930712038","https://openalex.org/W1977742988","https://openalex.org/W4409970030","https://openalex.org/W4413616547","https://openalex.org/W2898643119"],"abstract_inverted_index":{"Abstract":[0],"Objective:":[1],"This":[2],"research":[3],"presents":[4],"the":[5,22,44,90,108,113,123,127,137,194,200,211,219,240],"synthesis":[6],"of":[7,16,35,43,61,95,118,126,145,182,243,250],"fourteen":[8],"novel":[9,244],"coumarin":[10,28],"derivatives,":[11,97,213],"each":[12],"fused":[13,119],"with":[14,21,246],"one":[15],"two":[17],"distinct":[18],"five-membered":[19],"heterocycles,":[20],"aim":[23],"that":[24],"these":[25,62,96],"easily":[26],"accessible":[27],"frameworks":[29],"will":[30],"have":[31],"a":[32,247],"wide":[33],"range":[34,249],"modifiable":[36],"biomedical":[37,59,124],"applications.":[38],"Methods:":[39],"The":[40,58,105,116],"molecular":[41],"structures":[42],"synthesized":[45,212,220],"derivatives":[46,63,221,232],"were":[47,100,188,207],"confirmed":[48],"using":[49],"spectroscopic":[50],"methods,":[51],"namely":[52],"1H,":[53],"13C":[54],"NMR,":[55],"and":[56,69,83,92,103,140,152,165,171,177,186,228],"FT-IR.":[57],"potential":[60,125,156],"as":[64,157,235],"antiproliferative,":[65,176],"antioxidant,":[66,175],"antidiabetic,":[67],"anti-inflammatory,":[68],"antimicrobial":[70],"agents":[71],"was":[72,86],"evaluated":[73],"in":[74,143],"vitro.":[75],"Additionally,":[76],"their":[77,162],"biosafety":[78,178,201],"toward":[79],"non-infective":[80,204],"bacterial":[81,196,205],"strains":[82,197,206],"non-malignant":[84],"cells":[85],"assessed.":[87],"To":[88],"investigate":[89],"pharmacokinetic":[91],"toxicological":[93],"profiles":[94,202,224],"computational":[98],"tools":[99],"employed.":[101],"Results":[102],"Discussion:":[104],"authors":[106],"identified":[107],"following":[109],"key":[110],"outcomes":[111],"from":[112],"collected":[114],"data.":[115],"type":[117],"heterocycle":[120],"significantly":[121],"influences":[122],"investigated":[128],"derivatives.":[129],"Compound":[130],"A1":[131],"showed":[132],"considerable":[133],"anti-inflammatory":[134],"activity":[135],"via":[136],"lipoxygenase-dependent":[138],"pathway":[139],"outperformed":[141],"Nystatin":[142],"terms":[144,181],"antifungal":[146],"potential.":[147],"Compounds":[148,169],"A2,":[149],"A3,":[150],"B2,":[151],"B3":[153],"exhibited":[154,222],"great":[155],"antidiabetic":[158],"candidates":[159],"due":[160],"to":[161,190],"potent":[163],"glucosidase":[164],"amylase":[166],"inhibitory":[167],"properties.":[168],"A4":[170],"B4":[172],"demonstrated":[173],"strong":[174],"profiles.":[179],"In":[180],"antibacterial":[183],"activity,":[184],"A5":[185],"B5":[187],"comparable":[189],"Ciprofloxacin":[191],"against":[192,203],"all":[193,210],"aerobic":[195],"tested.":[198],"Moreover,":[199],"favorable":[208,223],"for":[209,215,239],"particularly":[214],"this":[216],"pair.":[217],"Lastly,":[218],"regarding":[225],"oral":[226],"bioavailability":[227],"toxicity.":[229],"Conclusions:":[230],"These":[231],"may":[233],"serve":[234],"valuable":[236],"building":[237],"blocks":[238],"future":[241],"development":[242],"pharmaceuticals":[245],"broad":[248],"bioactivities.":[251]},"counts_by_year":[],"updated_date":"2026-11-10T11:39:43.021295","created_date":"2025-12-01T00:00:00"}