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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Free fatty acid receptor 1' and Ligand = 'BDBM50306388'   
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
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50306388
PNG
(5-(4-(2,4-dichlorophenoxy)-2-(trifluoromethyl)benz...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(Oc2ccc(Cl)cc2Cl)cc1C(F)(F)F
Show InChI InChI=1S/C17H10Cl2F3NO3S/c18-9-2-4-13(12(19)6-9)26-10-3-1-8(11(7-10)17(20,21)22)5-14-15(24)23-16(25)27-14/h1-4,6-7,24H,5H2,(H,23,25)
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Similars
Article
PubMed
n/an/an/an/a 88n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA

Bioorg Med Chem Lett 20: 1298-301 (2010)


Article DOI: 10.1016/j.bmcl.2009.10.052
BindingDB Entry DOI: 10.7270/Q2QC03KS
More data for this
Ligand-Target Pair