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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A' and Ligand = 'BDBM50330477'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))		BDBM50330477
PNG
(3-Amino-2-[3-(4-benzothiazol-2-ylpiperazin-1-yl)pr...)
Show SMILES Cc1sc2nc(SCCCN3CCN(CC3)c3nc4ccccc4s3)n(N)c(=O)c2c1C
Show InChI InChI=1S/C22H26N6OS3/c1-14-15(2)31-19-18(14)20(29)28(23)22(25-19)30-13-5-8-26-9-11-27(12-10-26)21-24-16-6-3-4-7-17(16)32-21/h3-4,6-7H,5,8-13,23H2,1-2H3
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Article
PubMed
n/an/a 87.6n/an/an/an/an/an/a



ASKA Pharmaceutical Co, Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]BRL-43694 from human 5HT3 receptor expressed in HEK293 cells by liquid scintillation counting

J Med Chem 53: 7549-63 (2010)


Article DOI: 10.1021/jm1002292
BindingDB Entry DOI: 10.7270/Q27082D1
More data for this
Ligand-Target Pair