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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(3) dopamine receptor' and Ligand = 'BDBM50325744'   
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
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50325744
PNG
(CHEMBL1223683 | N-(4-(4-(2,3-dichlorophenyl)pipera...)
Show SMILES Clc1cccc(N2CCN(CCCCNc3ccc4ccccc4n3)CC2)c1Cl
Show InChI InChI=1S/C23H26Cl2N4/c24-19-7-5-9-21(23(19)25)29-16-14-28(15-17-29)13-4-3-12-26-22-11-10-18-6-1-2-8-20(18)27-22/h1-2,5-11H,3-4,12-17H2,(H,26,27)
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 0.600n/an/an/an/an/an/an/an/a



Bioprojet-Biotech

Curated by ChEMBL


Assay Description
Antagonist activity at D3 receptor (unknown origin)

Eur J Med Chem 125: 565-572 (2017)


Article DOI: 10.1016/j.ejmech.2016.09.074
BindingDB Entry DOI: 10.7270/Q20C4Z66
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50325744
PNG
(CHEMBL1223683 | N-(4-(4-(2,3-dichlorophenyl)pipera...)
Show SMILES Clc1cccc(N2CCN(CCCCNc3ccc4ccccc4n3)CC2)c1Cl
Show InChI InChI=1S/C23H26Cl2N4/c24-19-7-5-9-21(23(19)25)29-16-14-28(15-17-29)13-4-3-12-26-22-11-10-18-6-1-2-8-20(18)27-22/h1-2,5-11H,3-4,12-17H2,(H,26,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 23n/an/an/an/an/an/an/an/a



Université de Rennes I

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D3 receptor expressed in CHO cells

Bioorg Med Chem Lett 20: 5376-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.096
BindingDB Entry DOI: 10.7270/Q2TH8MXT
More data for this
Ligand-Target Pair