Compile Data Set for Download or QSAR
Found 68 Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50035834
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014749(3-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-1H-...)
Show SMILES Clc1ccc(cc1)C(c1ccn[nH]1)(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C19H14Cl2N4/c20-16-5-1-14(2-6-16)19(18-9-10-23-24-18,25-12-11-22-13-25)15-3-7-17(21)8-4-15/h1-13H,(H,23,24)
Affinity DataEC50:  61nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014750(3-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-pyr...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)(c1cccnc1)n1ccnc1
Show InChI InChI=1S/C21H15Cl2N3/c22-19-7-3-16(4-8-19)21(26-13-12-25-15-26,18-2-1-11-24-14-18)17-5-9-20(23)10-6-17/h1-15H
Affinity DataEC50:  50nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014752(1-[Bis-(2-chloro-phenyl)-methyl]-1H-imidazole | CH...)
Show SMILES Clc1ccccc1C(c1ccccc1Cl)n1ccnc1
Show InChI InChI=1S/C16H12Cl2N2/c17-14-7-3-1-5-12(14)16(20-10-9-19-11-20)13-6-2-4-8-15(13)18/h1-11,16H
Affinity DataEC50:  76nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014751(3-[1,1-Bis-(4-chloro-phenyl)-ethyl]-pyridine | CHE...)
Show SMILES CC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C19H15Cl2N/c1-19(16-3-2-12-22-13-16,14-4-8-17(20)9-5-14)15-6-10-18(21)11-7-15/h2-13H,1H3
Affinity DataEC50:  145nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014753(3-[Chloro-bis-(4-chloro-phenyl)-methyl]-pyridine :...)
Show SMILES Clc1ccc(cc1)C(Cl)(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C18H12Cl3N/c19-16-7-3-13(4-8-16)18(21,15-2-1-11-22-12-15)14-5-9-17(20)10-6-14/h1-12H
Affinity DataEC50:  200nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014754(1-[(4-Chloro-phenyl)-(4-methoxy-phenyl)-methyl]-1H...)
Show SMILES COc1ccc(cc1)C(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C17H15ClN2O/c1-21-16-8-4-14(5-9-16)17(20-11-10-19-12-20)13-2-6-15(18)7-3-13/h2-12,17H,1H3
Affinity DataEC50:  8.40nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014755(1-[Bis-(4-methoxy-phenyl)-methyl]-1H-imidazole | C...)
Show SMILES COc1ccc(cc1)C(c1ccc(OC)cc1)n1ccnc1
Show InChI InChI=1S/C18H18N2O2/c1-21-16-7-3-14(4-8-16)18(20-12-11-19-13-20)15-5-9-17(22-2)10-6-15/h3-13,18H,1-2H3
Affinity DataEC50:  13nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014756(1-[Bis-(4-chloro-phenyl)-methyl]-1H-imidazole | CH...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C16H12Cl2N2/c17-14-5-1-12(2-6-14)16(20-10-9-19-11-20)13-3-7-15(18)8-4-13/h1-11,16H
Affinity DataEC50:  42nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014760(Bis-(4-chloro-phenyl)-(1H-tetrazol-5-yl)-methanol ...)
Show SMILES OC(c1nnn[nH]1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C14H10Cl2N4O/c15-11-5-1-9(2-6-11)14(21,13-17-19-20-18-13)10-3-7-12(16)8-4-10/h1-8,21H,(H,17,18,19,20)
Affinity DataEC50: >5.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014758(Bis-(4-chloro-phenyl)-pyridin-3-yl-methanol | CHEM...)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C18H13Cl2NO/c19-16-7-3-13(4-8-16)18(22,15-2-1-11-21-12-15)14-5-9-17(20)10-6-14/h1-12,22H
Affinity DataEC50:  150nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014757((4-Chloro-phenyl)-(2-chloro-phenyl)-pyridin-3-yl-m...)
Show SMILES OC(c1ccc(Cl)cc1)(c1cccnc1)c1ccccc1Cl
Show InChI InChI=1S/C18H13Cl2NO/c19-15-9-7-13(8-10-15)18(22,14-4-3-11-21-12-14)16-5-1-2-6-17(16)20/h1-12,22H
Affinity DataEC50: >2.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014759(5-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-thi...)
Show SMILES Clc1ccc(cc1)C(c1cncs1)(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C19H13Cl2N3S/c20-16-5-1-14(2-6-16)19(18-11-23-13-25-18,24-10-9-22-12-24)15-3-7-17(21)8-4-15/h1-13H
Affinity DataEC50:  17nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014761(Bis-(4-chloro-phenyl)-(2H-[1,2,3]triazol-4-yl)-met...)
Show SMILES OC(c1cnn[nH]1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C15H11Cl2N3O/c16-12-5-1-10(2-6-12)15(21,14-9-18-20-19-14)11-3-7-13(17)8-4-11/h1-9,21H,(H,18,19,20)
Affinity DataEC50:  2.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014762(Bis-(4-chloro-phenyl)-piperidin-3-yl-methanol | CH...)
Show SMILES OC(C1CCCNC1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C18H19Cl2NO/c19-16-7-3-13(4-8-16)18(22,15-2-1-11-21-12-15)14-5-9-17(20)10-6-14/h3-10,15,21-22H,1-2,11-12H2
Affinity DataEC50: >5.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014766(Bis-(4-chloro-phenyl)-pyrimidin-4-yl-methanol | CH...)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccncn1
Show InChI InChI=1S/C17H12Cl2N2O/c18-14-5-1-12(2-6-14)17(22,16-9-10-20-11-21-16)13-3-7-15(19)8-4-13/h1-11,22H
Affinity DataEC50:  322nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014764(5-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-1H-...)
Show SMILES Clc1ccc(cc1)C(c1nnc[nH]1)(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C18H13Cl2N5/c19-15-5-1-13(2-6-15)18(17-22-11-23-24-17,25-10-9-21-12-25)14-3-7-16(20)8-4-14/h1-12H,(H,22,23,24)
Affinity DataEC50:  11nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014765(1-[Bis-(4-chloro-phenyl)-methyl]-piperidine | CHEM...)
Show SMILES Clc1ccc(cc1)C(N1CCCCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C18H19Cl2N/c19-16-8-4-14(5-9-16)18(21-12-2-1-3-13-21)15-6-10-17(20)11-7-15/h4-11,18H,1-3,12-13H2
Affinity DataEC50: >5.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014767(2-[Bis-(4-chloro-phenyl)-methyl]-1H-pyrrole | CHEM...)
Show SMILES Clc1ccc(cc1)C(c1ccc[nH]1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H13Cl2N/c18-14-7-3-12(4-8-14)17(16-2-1-11-20-16)13-5-9-15(19)10-6-13/h1-11,17,20H
Affinity DataEC50: >5.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014763(4-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-1H-...)
Show SMILES Clc1ccc(cc1)C(c1cn[nH]c1)(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C19H14Cl2N4/c20-17-5-1-14(2-6-17)19(16-11-23-24-12-16,25-10-9-22-13-25)15-3-7-18(21)8-4-15/h1-13H,(H,23,24)
Affinity DataEC50:  11nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014768((4-Chloro-2-methoxy-phenyl)-phenyl-pyridin-3-yl-me...)
Show SMILES COc1cc(Cl)ccc1C(O)(c1ccccc1)c1cccnc1
Show InChI InChI=1S/C19H16ClNO2/c1-23-18-12-16(20)9-10-17(18)19(22,14-6-3-2-4-7-14)15-8-5-11-21-13-15/h2-13,22H,1H3
Affinity DataEC50:  1.80E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014769(1-[Bis-(4-chloro-phenyl)-methyl]-1H-pyrazole | CHE...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)n1cccn1
Show InChI InChI=1S/C16H12Cl2N2/c17-14-6-2-12(3-7-14)16(20-11-1-10-19-20)13-4-8-15(18)9-5-13/h1-11,16H
Affinity DataEC50: >2.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014771(Bis-(4-chloro-phenyl)-thiazol-5-yl-methanol | CHEM...)
Show SMILES OC(c1cncs1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H11Cl2NOS/c17-13-5-1-11(2-6-13)16(20,15-9-19-10-21-15)12-3-7-14(18)8-4-12/h1-10,20H
Affinity DataEC50:  9.60nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014770(Bis-(4-chloro-phenyl)-(1H-imidazol-2-yl)-methanol ...)
Show SMILES OC(c1ncc[nH]1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O/c17-13-5-1-11(2-6-13)16(21,15-19-9-10-20-15)12-3-7-14(18)8-4-12/h1-10,21H,(H,19,20)
Affinity DataEC50:  670nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014773(1-[Bis-(4-bromo-phenyl)-methyl]-1H-imidazole | CHE...)
Show SMILES Brc1ccc(cc1)C(c1ccc(Br)cc1)n1ccnc1
Show InChI InChI=1S/C16H12Br2N2/c17-14-5-1-12(2-6-14)16(20-10-9-19-11-20)13-3-7-15(18)8-4-13/h1-11,16H
Affinity DataEC50:  8.90nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014772(3-[Bis-(4-chloro-phenyl)-fluoro-methyl]-pyridine |...)
Show SMILES FC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C18H12Cl2FN/c19-16-7-3-13(4-8-16)18(21,15-2-1-11-22-12-15)14-5-9-17(20)10-6-14/h1-12H
Affinity DataEC50:  200nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014775(5-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-pyr...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)(c1cncnc1)n1ccnc1
Show InChI InChI=1S/C20H14Cl2N4/c21-18-5-1-15(2-6-18)20(26-10-9-23-14-26,17-11-24-13-25-12-17)16-3-7-19(22)8-4-16/h1-14H
Affinity DataEC50:  26nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014776(1-[bis(4-chlorophenyl)(1H-imidazol-2-yl)methyl]-1H...)
Show SMILES Clc1ccc(cc1)C(c1ncc[nH]1)(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C19H14Cl2N4/c20-16-5-1-14(2-6-16)19(18-23-9-10-24-18,25-12-11-22-13-25)15-3-7-17(21)8-4-15/h1-13H,(H,23,24)
Affinity DataEC50:  9.40nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014777(1-Di-p-tolylmethyl-1H-imidazole | CHEMBL135381)
Show SMILES Cc1ccc(cc1)C(c1ccc(C)cc1)n1ccnc1
Show InChI InChI=1S/C18H18N2/c1-14-3-7-16(8-4-14)18(20-12-11-19-13-20)17-9-5-15(2)6-10-17/h3-13,18H,1-2H3
Affinity DataEC50:  6.40nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014774(Bis-(4-chloro-phenyl)-pyrazin-2-yl-methanol | CHEM...)
Show SMILES OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1cnccn1
Show InChI InChI=1S/C17H12Cl2N2O/c18-14-5-1-12(2-6-14)17(22,16-11-20-9-10-21-16)13-3-7-15(19)8-4-13/h1-11,22H
Affinity DataEC50:  94nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014779(1-[Bis-(4-chloro-phenyl)-methyl]-piperazine | CHEM...)
Show SMILES Clc1ccc(cc1)C(N1CCNCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H18Cl2N2/c18-15-5-1-13(2-6-15)17(21-11-9-20-10-12-21)14-3-7-16(19)8-4-14/h1-8,17,20H,9-12H2
Affinity DataEC50:  1.93E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014324(5-[Bis-(4-chloro-phenyl)-methyl]-pyrimidine | 5-[B...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1cncnc1
Show InChI InChI=1S/C17H12Cl2N2/c18-15-5-1-12(2-6-15)17(14-9-20-11-21-10-14)13-3-7-16(19)8-4-13/h1-11,17H
Affinity DataEC50:  55nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014778(Bis-(4-chloro-phenyl)-(1H-pyrazol-4-yl)-methanol |...)
Show SMILES OC(c1cn[nH]c1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O/c17-14-5-1-11(2-6-14)16(21,13-9-19-20-10-13)12-3-7-15(18)8-4-12/h1-10,21H,(H,19,20)
Affinity DataEC50:  30nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014782(1-[Bis-(4-chloro-phenyl)-methyl]-1H-[1,2,3]triazol...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)n1ccnn1
Show InChI InChI=1S/C15H11Cl2N3/c16-13-5-1-11(2-6-13)15(20-10-9-18-19-20)12-3-7-14(17)8-4-12/h1-10,15H
Affinity DataEC50:  19nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014780(1-[Bis-(4-chloro-phenyl)-methyl]-1H-[1,2,4]triazol...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)n1cncn1
Show InChI InChI=1S/C15H11Cl2N3/c16-13-5-1-11(2-6-13)15(20-10-18-9-19-20)12-3-7-14(17)8-4-12/h1-10,15H
Affinity DataEC50:  8.80nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014781(1-[(2-Methoxy-phenyl)-phenyl-methyl]-1H-imidazole ...)
Show SMILES COc1ccccc1C(c1ccccc1)n1ccnc1
Show InChI InChI=1S/C17H16N2O/c1-20-16-10-6-5-9-15(16)17(19-12-11-18-13-19)14-7-3-2-4-8-14/h2-13,17H,1H3
Affinity DataEC50:  66nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014785(Bis-(4-chloro-phenyl)-(1H-imidazol-4-yl)-methanol ...)
Show SMILES OC(c1cnc[nH]1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O/c17-13-5-1-11(2-6-13)16(21,15-9-19-10-20-15)12-3-7-14(18)8-4-12/h1-10,21H,(H,19,20)
Affinity DataEC50:  28nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014786(2-[Bis-(4-chloro-phenyl)-methyl]-2H-tetrazole | CH...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)n1ncnn1
Show InChI InChI=1S/C14H10Cl2N4/c15-12-5-1-10(2-6-12)14(20-18-9-17-19-20)11-3-7-13(16)8-4-11/h1-9,14H
Affinity DataEC50:  150nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014784((4-Chloro-phenyl)-pyridin-3-yl-(3-trifluoromethyl-...)
Show SMILES OC(c1ccc(Cl)cc1)(c1cccnc1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C19H13ClF3NO/c20-17-8-6-13(7-9-17)18(25,16-5-2-10-24-12-16)14-3-1-4-15(11-14)19(21,22)23/h1-12,25H
Affinity DataEC50:  650nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014783(2-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-pyr...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)(c1ccccn1)n1ccnc1
Show InChI InChI=1S/C21H15Cl2N3/c22-18-8-4-16(5-9-18)21(26-14-13-24-15-26,20-3-1-2-12-25-20)17-6-10-19(23)11-7-17/h1-15H
Affinity DataEC50:  29nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014788(1-Benzhydryl-1H-imidazole | CHEMBL336638)
Show SMILES c1cn(cn1)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C16H14N2/c1-3-7-14(8-4-1)16(18-12-11-17-13-18)15-9-5-2-6-10-15/h1-13,16H
Affinity DataEC50:  125nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014787(2-[Bis-(4-chloro-phenyl)-methyl]-pyridine | CHEMBL...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1ccccn1
Show InChI InChI=1S/C18H13Cl2N/c19-15-8-4-13(5-9-15)18(17-3-1-2-12-21-17)14-6-10-16(20)11-7-14/h1-12,18H
Affinity DataEC50: >5.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014790(2-[Bis-(4-chloro-phenyl)-methyl]-2H-[1,2,3]triazol...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)n1nccn1
Show InChI InChI=1S/C15H11Cl2N3/c16-13-5-1-11(2-6-13)15(20-18-9-10-19-20)12-3-7-14(17)8-4-12/h1-10,15H
Affinity DataEC50: >5.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014791(Bis-(4-chloro-phenyl)-(1H-pyrazol-3-yl)-methanol |...)
Show SMILES OC(c1ccn[nH]1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O/c17-13-5-1-11(2-6-13)16(21,15-9-10-19-20-15)12-3-7-14(18)8-4-12/h1-10,21H,(H,19,20)
Affinity DataEC50:  90nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014789((4-Chloro-phenyl)-pyridin-3-yl-p-tolyl-methanol : ...)
Show SMILES Cc1ccc(cc1)C(O)(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C19H16ClNO/c1-14-4-6-15(7-5-14)19(22,17-3-2-12-21-13-17)16-8-10-18(20)11-9-16/h2-13,22H,1H3
Affinity DataEC50:  230nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014795(3-[Bis-(4-chloro-phenyl)-methoxy-methyl]-pyridine ...)
Show SMILES COC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C19H15Cl2NO/c1-23-19(16-3-2-12-22-13-16,14-4-8-17(20)9-5-14)15-6-10-18(21)11-7-15/h2-13H,1H3
Affinity DataEC50:  1.60E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014794(3-[Bis-(4-chloro-phenyl)-methyl]-pyridine | CHEMBL...)
Show SMILES Clc1ccc(cc1)C(c1ccc(Cl)cc1)c1cccnc1
Show InChI InChI=1S/C18H13Cl2N/c19-16-7-3-13(4-8-16)18(15-2-1-11-21-12-15)14-5-9-17(20)10-6-14/h1-12,18H
Affinity DataEC50:  84nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014793(5-[Bis-(4-chloro-phenyl)-imidazol-1-yl-methyl]-iso...)
Show SMILES Clc1ccc(cc1)C(c1ccns1)(c1ccc(Cl)cc1)n1ccnc1
Show InChI InChI=1S/C19H13Cl2N3S/c20-16-5-1-14(2-6-16)19(18-9-10-23-25-18,24-12-11-22-13-24)15-3-7-17(21)8-4-15/h1-13H
Affinity DataEC50:  57nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014792(Bis-(4-methoxy-phenyl)-pyridin-3-yl-methanol | CHE...)
Show SMILES COc1ccc(cc1)C(O)(c1ccc(OC)cc1)c1cccnc1
Show InChI InChI=1S/C20H19NO3/c1-23-18-9-5-15(6-10-18)20(22,17-4-3-13-21-14-17)16-7-11-19(24-2)12-8-16/h3-14,22H,1-2H3
Affinity DataEC50: >2.00E+3nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014797(1-[Bis-(4-fluoro-phenyl)-methyl]-1H-imidazole | CH...)
Show SMILES Fc1ccc(cc1)C(c1ccc(F)cc1)n1ccnc1
Show InChI InChI=1S/C16H12F2N2/c17-14-5-1-12(2-6-14)16(20-10-9-19-11-20)13-3-7-15(18)8-4-13/h1-11,16H
Affinity DataEC50:  40nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
TargetAromatase(Rattus norvegicus)
Eli Lilly and Company

Curated by ChEMBL
LigandPNGBDBM50014796(1-[(4-Methoxy-phenyl)-p-tolyl-methyl]-1H-imidazole...)
Show SMILES COc1ccc(cc1)C(c1ccc(C)cc1)n1ccnc1
Show InChI InChI=1S/C18H18N2O/c1-14-3-5-15(6-4-14)18(20-12-11-19-13-20)16-7-9-17(21-2)10-8-16/h3-13,18H,1-2H3
Affinity DataEC50:  11nMAssay Description:In vitro Cytochrome P450 19A1 inhibition concentration to decrease aromatization of androstenedione in rat ovarian microsomeMore data for this Ligand-Target Pair
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