Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'Aromatase cytochrome P450'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Aromatase [1-48] (Homo sapiens (Human))	BDBM13061 (4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...) Show SMILES N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1cncn1 Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Biomolécules et Cibles Cellulaires Tumorales					Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion...				Bioorg Chem 32: 494-503 (2004) Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z
					More data for this Ligand-Target Pair
Aromatase [1-48] (Homo sapiens (Human))	BDBM85252 (2,4-Trans-4'-hydroxy-4-imidazolyl-7-methoxyfla...) Show SMILES COc1ccc2C(CC(Oc2c1)c1ccc(O)cc1)n1ccnc1 Show InChI InChI=1S/C19H18N2O3/c1-23-15-6-7-16-17(21-9-8-20-12-21)11-18(24-19(16)10-15)13-2-4-14(22)5-3-13/h2-10,12,17-18,22H,11H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Biomolécules et Cibles Cellulaires Tumorales					Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion...				Bioorg Chem 32: 494-503 (2004) Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z
					More data for this Ligand-Target Pair
Aromatase [1-48] (Homo sapiens (Human))	BDBM85253 (2,4-Trans-4',7-dihydroxy-4-imidazolyl-7-methox...) Show SMILES Oc1ccc(cc1)C1CC(c2ccc(O)cc2O1)n1ccnc1 Show InChI InChI=1S/C18H16N2O3/c21-13-3-1-12(2-4-13)17-10-16(20-8-7-19-11-20)15-6-5-14(22)9-18(15)23-17/h1-9,11,16-17,21-22H,10H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	77	n/a	n/a	n/a	n/a	n/a	n/a
Biomolécules et Cibles Cellulaires Tumorales					Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion...				Bioorg Chem 32: 494-503 (2004) Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z
					More data for this Ligand-Target Pair
Aromatase [1-48] (Homo sapiens (Human))	BDBM85249 (2,4-Trans-3'-hydroxy-4-imidazolyl-7-methoxyfla...) Show SMILES COc1ccc2C(CC(Oc2c1)c1cccc(O)c1)n1ccnc1 Show InChI InChI=1S/C19H18N2O3/c1-23-15-5-6-16-17(21-8-7-20-12-21)11-18(24-19(16)10-15)13-3-2-4-14(22)9-13/h2-10,12,17-18,22H,11H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Biomolécules et Cibles Cellulaires Tumorales					Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion...				Bioorg Chem 32: 494-503 (2004) Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z
					More data for this Ligand-Target Pair
Aromatase [1-48] (Homo sapiens (Human))	BDBM85251 (2,4-Trans-4'-cyano-4-imidazolyl-7-methoxyflava...) Show SMILES COc1ccc2C(CC(Oc2c1)c1ccc(cc1)C#N)n1ccnc1 Show InChI InChI=1S/C20H17N3O2/c1-24-16-6-7-17-18(23-9-8-22-13-23)11-19(25-20(17)10-16)15-4-2-14(12-21)3-5-15/h2-10,13,18-19H,11H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	133	n/a	n/a	n/a	n/a	n/a	n/a
Biomolécules et Cibles Cellulaires Tumorales					Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion...				Bioorg Chem 32: 494-503 (2004) Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z
					More data for this Ligand-Target Pair
Aromatase [1-48] (Homo sapiens (Human))	BDBM85250 (2,4-Trans-4'-chloro-4-imidazolyl-7-methoxyflav...) Show SMILES COc1ccc2C(CC(Oc2c1)c1ccc(Cl)cc1)n1ccnc1 Show InChI InChI=1S/C19H17ClN2O2/c1-23-15-6-7-16-17(22-9-8-21-12-22)11-18(24-19(16)10-15)13-2-4-14(20)5-3-13/h2-10,12,17-18H,11H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Biomolécules et Cibles Cellulaires Tumorales					Assay Description The inhibitory activities of the compounds toward aromatase were determined in vitro using human placental microsomes and [1,2,6,7-3H]-androstenedion...				Bioorg Chem 32: 494-503 (2004) Article DOI: 10.1016/j.bioorg.2004.06.008 BindingDB Entry DOI: 10.7270/Q21R6P2Z
					More data for this Ligand-Target Pair