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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50101653'   
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 1A


(Homo sapiens (Human))		BDBM50101653
PNG
(4-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethylam...)
Show SMILES COc1ccccc1N1CCN(CCNc2cc(C)nn(C)c2=O)CC1
Show InChI InChI=1S/C19H27N5O2/c1-15-14-16(19(25)22(2)21-15)20-8-9-23-10-12-24(13-11-23)17-6-4-5-7-18(17)26-3/h4-7,14,20H,8-13H2,1-3H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
 32.1n/an/an/an/an/an/an/an/a



Istituto Chimico Farmaceutico e Tossicologico

Curated by ChEMBL


Assay Description
Binding affinity towards human cloned 5-hydroxytryptamine 1A receptor using [3H]-8-OH-DPAT as radioligand

J Med Chem 44: 2403-10 (2001)


BindingDB Entry DOI: 10.7270/Q2WS8SHW
More data for this
Ligand-Target Pair