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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aromatase (CYP19)' and Ligand = 'BDBM50079819'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aromatase (CYP19)


(Homo sapiens (Human))
BDBM50079819
PNG
(1-[(2,4-Dichloro-phenyl)-(2,3-dihydro-benzofuran-2...)
Show SMILES Clc1ccc(C(C2Cc3ccccc3O2)n2cnnn2)c(Cl)c1
Show InChI InChI=1S/C16H12Cl2N4O/c17-11-5-6-12(13(18)8-11)16(22-9-19-20-21-22)15-7-10-3-1-2-4-14(10)23-15/h1-6,8-9,15-16H,7H2
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
n/an/a 5.20E+4n/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of human placental aromatase, cytochrome P450 19A1


Bioorg Med Chem Lett 9: 2105-8 (1999)


BindingDB Entry DOI: 10.7270/Q2SQ8ZK7
More data for this
Ligand-Target Pair