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TargetAromatase
LigandBDBM9473
Substrate/CompetitorBDBM8885
Meas. Tech.CYP19 Assay
pH7.4±n/a
Temperature303.15±n/a K
IC50 760±n/a nM
Citation Leonetti, FFavia, ARao, AAliano, RPaluszcak, AHartmann, RWCarotti, A Design, synthesis, and 3D QSAR of novel potent and selective aromatase inhibitors. J Med Chem47:6792-803 (2004) [PubMed]  Article
More Info.:Get all data from this article,  Inhibition_Run data,   Solution Info,  Assay Method
 
Aromatase
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:
MVLEMLNPIHYNITSIVPEAMPAATMPVLLLTGLFLLVWNYEGTSSIPGPGYCMGIGPLI
SHGRFLWMGIGSACNYYNRVYGEFMRVWISGEETLIISKSSSMFHIMKHNHYSSRFGSKL
GLQCIGMHEKGIIFNNNPELWKTTRPFFMKALSGPGLVRMVTVCAESLKTHLDRLEEVTN
ESGYVDVLTLLRRVMLDTSNTLFLRIPLDESAIVVKIQGYFDAWQALLIKPDIFFKISWL
YKKYEKSVKDLKDAIEVLIAEKRRRISTEEKLEECMDFATELILAEKRGDLTRENVNQCI
LEMLIAAPDTMSVSLFFMLFLIAKHPNVEEAIIKEIQTVIGERDIKIDDIQKLKVMENFI
YESMRYQPVVDLVMRKALEDDVIDGYPVKKGTNIILNIGRMHRLEFFPKPNEFTLENFAK
NVPYRYFQPFGFGPRGCAGKYIAMVMMKAILVTLLRRFHVKTLQGQCVESIQKIHDLSLH
PDETKNMLEMIFTPRNSDRCLEH
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  Blast E-value cutoff:
BDBM9473
BDBM8885
NameBDBM9473
Synonyms:4-[2-(1H-Imidazol-1-yl)ethoxy]-2H-chromen-2-one | CHEMBL225178 | Coumarin deriv. 22
TypeSmall organic molecule
Emp. Form.C14H12N2O3
Mol. Mass.256.2567
SMILESO=c1cc(OCCn2ccnc2)c2ccccc2o1
Structure
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