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BDBM50070097 (Z)-6-(4-chlorophenyl)-7-(pyridin-4-ylmethylene)-6,7-dihydroindolizin-8(5H)-one::6-(4-Chloro-phenyl)-7-[1-pyridin-4-yl-meth-(Z)-ylidene]-6,7-dihydro-5H-indolizin-8-one::CHEMBL9165::MR-20492

SMILES: Clc1ccc(cc1)C1Cn2cccc2C(=O)\C1=C/c1ccncc1

InChI Key: InChIKey=OMGJLQMHGRFTAP-ATVHPVEESA-N

Data: 1 KI  3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50070097   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50070097
PNG
((Z)-6-(4-chlorophenyl)-7-(pyridin-4-ylmethylene)-6...)
Show SMILES Clc1ccc(cc1)C1Cn2cccc2C(=O)\C1=C/c1ccncc1
Show InChI InChI=1S/C20H15ClN2O/c21-16-5-3-15(4-6-16)18-13-23-11-1-2-19(23)20(24)17(18)12-14-7-9-22-10-8-14/h1-12,18H,13H2/b17-12-
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PubMed
10n/an/an/an/an/an/an/an/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie

Curated by ChEMBL


Assay Description
Inhibition constant for human aromatase cytochrome P450 19A1 activity


Bioorg Med Chem Lett 8: 1041-4 (1999)


BindingDB Entry DOI: 10.7270/Q2445KM7
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50070097
PNG
((Z)-6-(4-chlorophenyl)-7-(pyridin-4-ylmethylene)-6...)
Show SMILES Clc1ccc(cc1)C1Cn2cccc2C(=O)\C1=C/c1ccncc1
Show InChI InChI=1S/C20H15ClN2O/c21-16-5-3-15(4-6-16)18-13-23-11-1-2-19(23)20(24)17(18)12-14-7-9-22-10-8-14/h1-12,18H,13H2/b17-12-
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Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Johns Hopkins University

Curated by ChEMBL


Assay Description
Inhibition of human placental microsome CYP19


Bioorg Med Chem Lett 20: 3050-64 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.113
BindingDB Entry DOI: 10.7270/Q2CJ8FFS
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50070097
PNG
((Z)-6-(4-chlorophenyl)-7-(pyridin-4-ylmethylene)-6...)
Show SMILES Clc1ccc(cc1)C1Cn2cccc2C(=O)\C1=C/c1ccncc1
Show InChI InChI=1S/C20H15ClN2O/c21-16-5-3-15(4-6-16)18-13-23-11-1-2-19(23)20(24)17(18)12-14-7-9-22-10-8-14/h1-12,18H,13H2/b17-12-
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PubMed
n/an/a 200n/an/an/an/an/an/a



Centre d'Etudes et de Recherche sur le Médicament de Normandie

Curated by ChEMBL


Assay Description
Inhibition of human aromatase cytochrome P450 19A1 activity


Bioorg Med Chem Lett 8: 1041-4 (1999)


BindingDB Entry DOI: 10.7270/Q2445KM7
More data for this
Ligand-Target Pair
Cytochrome P450 19A1


(Homo sapiens (Human))
BDBM50070097
PNG
((Z)-6-(4-chlorophenyl)-7-(pyridin-4-ylmethylene)-6...)
Show SMILES Clc1ccc(cc1)C1Cn2cccc2C(=O)\C1=C/c1ccncc1
Show InChI InChI=1S/C20H15ClN2O/c21-16-5-3-15(4-6-16)18-13-23-11-1-2-19(23)20(24)17(18)12-14-7-9-22-10-8-14/h1-12,18H,13H2/b17-12-
PDB
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Article
PubMed
n/an/a 150n/an/an/an/an/an/a



University of Botswana

Curated by ChEMBL


Assay Description
Inhibition of aromatase


Eur J Med Chem 46: 5237-57 (2011)


Article DOI: 10.1016/j.ejmech.2011.08.042
BindingDB Entry DOI: 10.7270/Q2ZG6SNF
More data for this
Ligand-Target Pair