Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A/3B/3C/3D/3E' and Ligand = 'BDBM50122876'   

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/3C/3D/3E (Homo sapiens (Human))	BDBM50122876 (4-Amino-5-chloro-2-methoxy-N-(1-methylamino-cyclop...) Show SMILES CNC1(CNC(=O)c2cc(Cl)c(N)cc2OC)CCCC1 Show InChI InChI=1S/C15H22ClN3O2/c1-18-15(5-3-4-6-15)9-19-14(20)10-7-11(16)12(17)8-13(10)21-2/h7-8,18H,3-6,9,17H2,1-2H3,(H,19,20)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Tested for 5-hydroxytryptamine 3 receptor anatagonist activity				J Med Chem 46: 319-44 (2003) BindingDB Entry DOI: 10.7270/Q2T72J6J
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