Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A/3B' and Ligand = 'BDBM50280498'   

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
5-hydroxytryptamine receptor 3A/3B (Rattus norvegicus-RAT)	BDBM50280498 (6-Amino-2-(1-aza-bicyclo[2.2.2]oct-3-yl)-benzo[de]...) Show SMILES Nc1ccc2C(=O)N(C3CN4CCC3CC4)C(=O)c3cccc1c23 |(5.44,-5.69,;6.98,-5.6,;7.67,-4.24,;9.21,-4.16,;10.03,-5.43,;11.59,-5.32,;12.27,-3.95,;12.43,-6.63,;13.97,-6.55,;14.8,-7.85,;16.34,-7.77,;17.03,-6.39,;16.18,-5.1,;14.64,-5.17,;15.04,-6.66,;16.04,-6.2,;11.72,-8.02,;12.57,-9.31,;10.18,-8.11,;9.48,-9.46,;7.95,-9.54,;7.11,-8.25,;7.81,-6.86,;9.34,-6.8,)| Show InChI InChI=1S/C19H19N3O2/c20-15-5-4-14-17-12(15)2-1-3-13(17)18(23)22(19(14)24)16-10-21-8-6-11(16)7-9-21/h1-5,11,16H,6-10,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Antagonistic activity against Serotonin 5-hydroxytryptamine 3 receptor of isolated guinea pig ileum (GPI)				Bioorg Med Chem Lett 2: 691-694 (1992) Article DOI: 10.1016/S0960-894X(00)80392-3 BindingDB Entry DOI: 10.7270/Q2B85814
					More data for this Ligand-Target Pair