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Target
Aromatase
Ligand
BDBM50345189
Substrate
n/a
Meas. Tech.
ChEMBL_751246 (CHEMBL1787614)
IC50
36±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:
BDBM50345189
Synonyms:
2,4-trans-7,8-benzo-4-imidazolylflavan | CHEMBL1783176
Type:
Small organic molecule
Emp. Form.:
C22H18N2O
Mol. Mass.:
326.3911
SMILES:
C1C(Oc2c(ccc3ccccc23)C1n1ccnc1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: