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BDBM50436035 CHEMBL2392146

SMILES: CCC(=O)Nc1cccc2c1oc(cc2=O)C(O)=O

InChI Key: InChIKey=VJWBOVFPGASJKO-UHFFFAOYSA-N

Data: 1 KI  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50436035   
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
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50436035
PNG
(CHEMBL2392146)
Show SMILES CCC(=O)Nc1cccc2c1oc(cc2=O)C(O)=O
Show InChI InChI=1S/C13H11NO5/c1-2-11(16)14-8-5-3-4-7-9(15)6-10(13(17)18)19-12(7)8/h3-6H,2H2,1H3,(H,14,16)(H,17,18)
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.77E+3n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]PSB-13253 from human recombinant GPR35 exprssed in CHO cells by liquid scintillation counting analysis


J Med Chem 56: 7084-99 (2013)

Checked by Author
Article DOI: 10.1021/jm4009373
BindingDB Entry DOI: 10.7270/Q2G16280
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50436035
PNG
(CHEMBL2392146)
Show SMILES CCC(=O)Nc1cccc2c1oc(cc2=O)C(O)=O
Show InChI InChI=1S/C13H11NO5/c1-2-11(16)14-8-5-3-4-7-9(15)6-10(13(17)18)19-12(7)8/h3-6H,2H2,1H3,(H,14,16)(H,17,18)
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.34E+4n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR35 expressed in CHO cells assessed as induction of beta-arrestin recruitment after 90 mins by beta-galactosidase reporte...


J Med Chem 56: 5182-97 (2013)


Article DOI: 10.1021/jm400587g
BindingDB Entry DOI: 10.7270/Q20C4X5B
More data for this
Ligand-Target Pair