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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 = 'BDBM50244016'   
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))
BDBM50244016
PNG
(CHEMBL4070443)
Show SMILES COc1ccc(F)c(c1)N1CCC(Cc2ccc(cc2)N2C[C@@H](C[C@@H]2CC(O)=O)C(F)(F)F)CC1 |r|
Show InChI InChI=1S/C26H30F4N2O3/c1-35-22-6-7-23(27)24(15-22)31-10-8-18(9-11-31)12-17-2-4-20(5-3-17)32-16-19(26(28,29)30)13-21(32)14-25(33)34/h2-7,15,18-19,21H,8-14,16H2,1H3,(H,33,34)/t19-,21-/m1/s1
PDB

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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 530n/an/an/an/a



Bristol-Myers Squibb Co.

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHOA12 cells assessed as induction of Ca2+ mobilization by FLIPR assay


J Med Chem 61: 681-694 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00982
BindingDB Entry DOI: 10.7270/Q24T6MTM
More data for this
Ligand-Target Pair