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BDBM50171855 CHEMBL3806055

SMILES: Cc1cccc(NC(=O)c2nnc(COc3ccc(CCC(O)=O)cc3)s2)c1

InChI Key: InChIKey=ARDGJUQITBHNLR-UHFFFAOYSA-N

Data: 1 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50171855   
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
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50171855
PNG
(CHEMBL3806055)
Show SMILES Cc1cccc(NC(=O)c2nnc(COc3ccc(CCC(O)=O)cc3)s2)c1
Show InChI InChI=1S/C20H19N3O4S/c1-13-3-2-4-15(11-13)21-19(26)20-23-22-17(28-20)12-27-16-8-5-14(6-9-16)7-10-18(24)25/h2-6,8-9,11H,7,10,12H2,1H3,(H,21,26)(H,24,25)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 1.77E+3n/an/an/an/a



Saint Petersburg State University

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells by calcium influx assay


Bioorg Med Chem 24: 2954-2963 (2016)


Article DOI: 10.1016/j.bmc.2016.04.065
BindingDB Entry DOI: 10.7270/Q2SB47PK
More data for this
Ligand-Target Pair