Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A/3B' and Ligand = 'BDBM50452960'   

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)	BDBM50452960 (CHEMBL286001) Show SMILES Cc1ccc2n(C)cc(-c3noc(n3)C3CN4CCC3CC4)c2c1 |(2.61,-10.67,;4.02,-11.52,;4,-13.28,;5.51,-14.18,;7.05,-13.34,;8.54,-13.73,;8.53,-15.38,;9.88,-12.97,;9.88,-11.45,;11.22,-10.69,;11.21,-9.26,;13.68,-9.25,;13.69,-10.67,;12.46,-11.41,;15.04,-11.43,;15.04,-12.96,;16.27,-13.66,;17.68,-12.94,;17.68,-11.41,;16.34,-10.63,;15.57,-11.96,;17.05,-12.35,;7.08,-11.56,;5.55,-10.67,)| Show InChI InChI=1S/C19H22N4O/c1-12-3-4-17-14(9-12)16(10-22(17)2)18-20-19(24-21-18)15-11-23-7-5-13(15)6-8-23/h3-4,9-10,13,15H,5-8,11H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	331	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]-Q-ICS 205-930 binding to 5-hydroxytryptamine 3 receptor recognition sites in rat brain membranes.				J Med Chem 34: 140-51 (1991) BindingDB Entry DOI: 10.7270/Q2DV1MD5
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