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Target
Aromatase
Ligand
BDBM50345187
Substrate
n/a
Meas. Tech.
ChEMBL_751246 (CHEMBL1787614)
IC50
1540±n/a nM
Citation
 Yahiaoui, S; Pouget, C; Buxeraud, J; Chulia, AJ; Fagnère, C Lead optimization of 4-imidazolylflavans: new promising aromatase inhibitors. Eur J Med Chem 46:2541-5 (2011) [PubMed]  Article 
Target
Name:
Aromatase
Synonyms:
ARO1 | Aromatase | CP19A_HUMAN | CYAR | CYP19 | CYP19A1 | CYPXIX | Cytochrome P-450AROM | Cytochrome P450 19A1 | Cytochrome P450 2C19 | Cytochrome P450-C19 (CYP19) | Estrogen synthetase | FL cytokine receptor precursor | P-450AROM
Type:
Enzyme
Mol. Mass.:
57888.92
Organism:
Homo sapiens (Human)
Description:
P11511
Residue:
503
Sequence:
MVLEMLNPIHYNITSIVPEAMPAATMPVLLLTGLFLLVWNYEGTSSIPGPGYCMGIGPLISHGRFLWMGIGSACNYYNRVYGEFMRVWISGEETLIISKSSSMFHIMKHNHYSSRFGSKLGLQCIGMHEKGIIFNNNPELWKTTRPFFMKALSGPGLVRMVTVCAESLKTHLDRLEEVTNESGYVDVLTLLRRVMLDTSNTLFLRIPLDESAIVVKIQGYFDAWQALLIKPDIFFKISWLYKKYEKSVKDLKDAIEVLIAEKRRRISTEEKLEECMDFATELILAEKRGDLTRENVNQCILEMLIAAPDTMSVSLFFMLFLIAKHPNVEEAIIKEIQTVIGERDIKIDDIQKLKVMENFIYESMRYQPVVDLVMRKALEDDVIDGYPVKKGTNIILNIGRMHRLEFFPKPNEFTLENFAKNVPYRYFQPFGFGPRGCAGKYIAMVMMKAILVTLLRRFHVKTLQGQCVESIQKIHDLSLHPDETKNMLEMIFTPRNSDRCLEH
  
Inhibitor
Name:
BDBM50345187
Synonyms:
4-(4-oxo-3,4-dihydro-2H-benzo[h]chromen-2-yl)benzonitrile | CHEMBL255108
Type:
Small organic molecule
Emp. Form.:
C20H13NO2
Mol. Mass.:
299.3227
SMILES:
O=C1CC(Oc2c1ccc1ccccc21)c1ccc(cc1)C#N
Structure:
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