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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM50073440'   
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 2A


(Rattus norvegicus (rat))		BDBM50073440
PNG
(2-{3-[(R)-4-(3-Chloro-phenyl)-2-methyl-piperazin-1...)
Show SMILES C[C@@H]1CN(CCN1CCCn1nc2ccccn2c1=O)c1cccc(Cl)c1
Show InChI InChI=1S/C20H24ClN5O/c1-16-15-24(18-7-4-6-17(21)14-18)13-12-23(16)9-5-11-26-20(27)25-10-3-2-8-19(25)22-26/h2-4,6-8,10,14,16H,5,9,11-13,15H2,1H3/t16-/m1/s1
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Article
PubMed
n/an/a 234n/an/an/an/an/an/a



Angelini Ricerche S.p.A.

Curated by ChEMBL


Assay Description
Compound was tested for it's binding affinity towards 5-hydroxytryptamine 2A receptor

J Med Chem 42: 336-45 (1999)


Article DOI: 10.1021/jm970700n
BindingDB Entry DOI: 10.7270/Q2Q52NSS
More data for this
Ligand-Target Pair