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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 35' and Ligand = 'BDBM50436032'   
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
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50436032
PNG
(CHEMBL2392154)
Show SMILES OC(=O)c1cc(=O)c2cccc(NC(=O)c3cccc(c3)[N+]([O-])=O)c2o1
Show InChI InChI=1S/C17H10N2O7/c20-13-8-14(17(22)23)26-15-11(13)5-2-6-12(15)18-16(21)9-3-1-4-10(7-9)19(24)25/h1-8H,(H,18,21)(H,22,23)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4.39E+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
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50436032
PNG
(CHEMBL2392154)
Show SMILES OC(=O)c1cc(=O)c2cccc(NC(=O)c3cccc(c3)[N+]([O-])=O)c2o1
Show InChI InChI=1S/C17H10N2O7/c20-13-8-14(17(22)23)26-15-11(13)5-2-6-12(15)18-16(21)9-3-1-4-10(7-9)19(24)25/h1-8H,(H,18,21)(H,22,23)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 6.97E+3n/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
More data for this
Ligand-Target Pair