Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histamine H2 receptor' and Ligand = 'BDBM50413502'   

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
Histamine H2 receptor (Cavia porcellus (domestic guinea pig))	BDBM50413502 (CHEMBL474447 | UR-PI104) Show SMILES NC(NC(=O)Cc1c[nH]c2ccccc12)=NCCCc1cnc[nH]1 |w:15.17| Show InChI InChI=1S/C17H20N6O/c18-17(20-7-3-4-13-10-19-11-22-13)23-16(24)8-12-9-21-15-6-2-1-5-14(12)15/h1-2,5-6,9-11,21H,3-4,7-8H2,(H,19,22)(H3,18,20,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	182	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at histamine H2 receptor in guinea pig atrium assessed as increase in heart rate				J Med Chem 52: 2623-7 (2009) Article DOI: 10.1021/jm9000693 BindingDB Entry DOI: 10.7270/Q2P270BN
					More data for this Ligand-Target Pair
Histamine H2 receptor (Homo sapiens (Human))	BDBM50413502 (CHEMBL474447 | UR-PI104) Show SMILES NC(NC(=O)Cc1c[nH]c2ccccc12)=NCCCc1cnc[nH]1 |w:15.17| Show InChI InChI=1S/C17H20N6O/c18-17(20-7-3-4-13-10-19-11-22-13)23-16(24)8-12-9-21-15-6-2-1-5-14(12)15/h1-2,5-6,9-11,21H,3-4,7-8H2,(H,19,22)(H3,18,20,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	36	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at human H2 receptor expressed in insect Sf9 cells co-expressing GsalphaS fusion protein assessed as gamma[32P]GTP binding by liquid...				J Med Chem 52: 2623-7 (2009) Article DOI: 10.1021/jm9000693 BindingDB Entry DOI: 10.7270/Q2P270BN
					More data for this Ligand-Target Pair