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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 3A/3B' and Ligand = 'BDBM50060265'   
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/3B


(Rattus norvegicus-RAT)		BDBM50060265
PNG
(1-(1-Aza-bicyclo[2.2.2]oct-3-yl)-3-(4-chloro-pheny...)
Show SMILES Clc1ccc(cc1)N1CCN(C2CN3CCC2CC3)C1=O |THB:10:11:15.14:17.18,(.04,-18.2,;1.38,-17.43,;2.71,-18.2,;4.05,-17.43,;4.05,-15.87,;2.71,-15.1,;1.38,-15.87,;5.38,-15.08,;6.78,-15.71,;7.81,-14.57,;7.04,-13.22,;7.65,-11.8,;7.87,-10.39,;9.14,-9.01,;8.69,-8.01,;8.27,-9.1,;8.81,-10.36,;10.65,-10.6,;10.94,-9.23,;5.53,-13.56,;4.37,-12.53,)|
Show InChI InChI=1S/C16H20ClN3O/c17-13-1-3-14(4-2-13)19-9-10-20(16(19)21)15-11-18-7-5-12(15)6-8-18/h1-4,12,15H,5-11H2
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 210n/an/an/an/an/an/an/an/a



Pharmacia& Upjohn

Curated by ChEMBL


Assay Description
In vitro affinity for 5-hydroxytryptamine 3 (5-HT3) receptor by displacement of [3H]BRL-43694 from rat entorhinal cortex

J Med Chem 40: 3369-80 (1997)


Article DOI: 10.1021/jm970060o
BindingDB Entry DOI: 10.7270/Q2X63NNK
More data for this
Ligand-Target Pair