Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 35' and Ligand = 'BDBM50259842'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
G-protein coupled receptor 35 (Homo sapiens (Human))	BDBM50259842 (CHEMBL4079816) Show SMILES Oc1c(cc2cc(-c3nnn[nH]3)c(=O)oc2c1[N+]([O-])=O)[N+]([O-])=O Show InChI InChI=1S/C10H4N6O7/c17-7-5(15(19)20)2-3-1-4(9-11-13-14-12-9)10(18)23-8(3)6(7)16(21)22/h1-2,17H,(H,11,12,13,14)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Dalian Institute of Chemical Physics Curated by ChEMBL					Assay Description Agonist activity at GPR35 in human HT-29 cells assessed as induction of cell desensitization to 1 uM zaprinast preincubated for 1 hr followed by zapr...				J Med Chem 60: 362-372 (2017) Article DOI: 10.1021/acs.jmedchem.6b01431 BindingDB Entry DOI: 10.7270/Q2J67KC8
					More data for this Ligand-Target Pair
G-protein coupled receptor 35 (Homo sapiens (Human))	BDBM50259842 (CHEMBL4079816) Show SMILES Oc1c(cc2cc(-c3nnn[nH]3)c(=O)oc2c1[N+]([O-])=O)[N+]([O-])=O Show InChI InChI=1S/C10H4N6O7/c17-7-5(15(19)20)2-3-1-4(9-11-13-14-12-9)10(18)23-8(3)6(7)16(21)22/h1-2,17H,(H,11,12,13,14)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
Dalian Institute of Chemical Physics Curated by ChEMBL					Assay Description Agonist activity at GPR35 in human HT-29 cells by DMR assay				J Med Chem 60: 362-372 (2017) Article DOI: 10.1021/acs.jmedchem.6b01431 BindingDB Entry DOI: 10.7270/Q2J67KC8
					More data for this Ligand-Target Pair
G-protein coupled receptor 35 (Homo sapiens (Human))	BDBM50259842 (CHEMBL4079816) Show SMILES Oc1c(cc2cc(-c3nnn[nH]3)c(=O)oc2c1[N+]([O-])=O)[N+]([O-])=O Show InChI InChI=1S/C10H4N6O7/c17-7-5(15(19)20)2-3-1-4(9-11-13-14-12-9)10(18)23-8(3)6(7)16(21)22/h1-2,17H,(H,11,12,13,14)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	288	n/a	n/a	n/a	n/a
Dalian Institute of Chemical Physics Curated by ChEMBL					Assay Description Agonist activity at TEV protease cleavage site linked GAL4-VP16-fused GPR35 in human Tango GPR35-bla U2OS cells assessed as induction of TEV protease...				J Med Chem 60: 362-372 (2017) Article DOI: 10.1021/acs.jmedchem.6b01431 BindingDB Entry DOI: 10.7270/Q2J67KC8
					More data for this Ligand-Target Pair