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Target
Aromatase
Ligand
BDBM50003135
Substrate
n/a
Meas. Tech.
ChEMBL_50556 (CHEMBL660334)
IC50
2400±n/a nM
Citation
 McCague, R; Rowlands, MG Conformational analysis of the aromatase inhibitor 3-ethyl-3-(4-pyridyl)piperidine-2,6-dione (rogletimide) and discovery of potent 5-alkyl derivatives. J Med Chem 35:3699-704 (1992) [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:
BDBM50003135
Synonyms:
(R)-3-Ethyl-5-octyl-4,5-dihydro-3H-[3,4']bipyridinyl-2,6-dione | (S)-3-Ethyl-5-octyl-4,5-dihydro-3H-[3,4']bipyridinyl-2,6-dione | 3-Ethyl-5-octyl-4,5-dihydro-3H-[3,4']bipyridinyl-2,6-dione | CHEMBL331522
Type:
Small organic molecule
Emp. Form.:
C20H30N2O2
Mol. Mass.:
330.4644
SMILES:
CCCCCCCC[C@H]1C[C@@](CC)(C(=O)NC1=O)c1ccncc1
Structure:
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