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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with all data for assayid = 2 entry = 50014361   
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
Cytochrome P450 2C9


(Homo sapiens (Human))
BDBM50575236
PNG
(CHEMBL4874673)
Show SMILES Cc1c(nnn1-c1ccccn1)C(=O)Nc1ccc2COB(O)c2c1
PDB
MMDB

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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of CYP2C9 in pooled human liver microsomes using diclofenac as substrate preincubated for 30 mins in presence of NADPH followed by substra...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01437
BindingDB Entry DOI: 10.7270/Q24Q7ZT3
More data for this
Ligand-Target Pair