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BDBM50090663 7-Ethynyl-4-hydroxy-3-(2-oxo-1-phenyl-propyl)-chromen-2-one::CHEMBL320460

SMILES: CC(=O)C(c1ccccc1)c1c(O)c2ccc(cc2oc1=O)C#C

InChI Key: InChIKey=PMEMXPNIESRSOW-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50090663   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cytochrome P450 2C9


(Homo sapiens (Human))
BDBM50090663
PNG
(7-Ethynyl-4-hydroxy-3-(2-oxo-1-phenyl-propyl)-chro...)
Show SMILES CC(=O)C(c1ccccc1)c1c(O)c2ccc(cc2oc1=O)C#C
Show InChI InChI=1S/C20H14O4/c1-3-13-9-10-15-16(11-13)24-20(23)18(19(15)22)17(12(2)21)14-7-5-4-6-8-14/h1,4-11,17,22H,2H3
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
1.10E+3n/an/an/an/an/an/an/an/a



Washington State University

Curated by ChEMBL


Assay Description
Binding affinity was measured on Cytochrome P450 2C9


J Med Chem 43: 2789-96 (2000)


BindingDB Entry DOI: 10.7270/Q2K64H9Q
More data for this
Ligand-Target Pair