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Found 1 hit Enz. Inhib. hit(s) with Target = 'Liver carboxylesterase' and Ligand = 'BDBM50358314'   
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
Liver carboxylesterase


(Sus scrofa)		BDBM50358314
PNG
(CHEMBL1922543)
Show SMILES CC(C)[C@@H](Cn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1)NC(=O)CN(Cc1ccccc1)C(=O)[C@H](C)NC(=O)OC(C)(C)C |r|
Show InChI InChI=1S/C29H41F6N6O7P/c1-18(2)22(15-41-14-21(38-39-41)17-46-49(7,45)48-25(28(30,31)32)29(33,34)35)37-23(42)16-40(13-20-11-9-8-10-12-20)24(43)19(3)36-26(44)47-27(4,5)6/h8-12,14,18-19,22,25H,13,15-17H2,1-7H3,(H,36,44)(H,37,42)/t19-,22+,49?/m0/s1
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PC cid
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Similars
Article
PubMed
n/an/a 7.85E+5n/an/an/an/an/an/a



Moscow State University

Curated by ChEMBL


Assay Description
Inhibition of pig liver carboxylesterase using p-nitrophenyl acetate as substrate by spectrophotometric analysis

Bioorg Med Chem Lett 21: 7216-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.030
BindingDB Entry DOI: 10.7270/Q2W66M65
More data for this
Ligand-Target Pair