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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50216054'   
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(2) dopamine receptor


(Homo sapiens (Human))
BDBM50216054
PNG
(1-(4-(4-(4-chlorophenyl)-1-piperazinyl)butyl)indol...)
Show SMILES Clc1ccc(cc1)N1CCN(CCCCN2C(=O)Cc3ccccc23)CC1
Show InChI InChI=1S/C22H26ClN3O/c23-19-7-9-20(10-8-19)25-15-13-24(14-16-25)11-3-4-12-26-21-6-2-1-5-18(21)17-22(26)27/h1-2,5-10H,3-4,11-17H2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
375n/an/an/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Antagonist activity at human Dopamine receptor D2 isoform long expressed in HEK293 cells assessed as change in quinpirole-induced intracellular calci...


Bioorg Med Chem 15: 5811-8 (2007)


Article DOI: 10.1016/j.bmc.2007.06.002
BindingDB Entry DOI: 10.7270/Q27M07MZ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50216054
PNG
(1-(4-(4-(4-chlorophenyl)-1-piperazinyl)butyl)indol...)
Show SMILES Clc1ccc(cc1)N1CCN(CCCCN2C(=O)Cc3ccccc23)CC1
Show InChI InChI=1S/C22H26ClN3O/c23-19-7-9-20(10-8-19)25-15-13-24(14-16-25)11-3-4-12-26-21-6-2-1-5-18(21)17-22(26)27/h1-2,5-10H,3-4,11-17H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.75E+3n/an/an/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Displacement of [3H]Spiperone from human Dopamine receptor D2 isoform long expressed in HEK293 cells


Bioorg Med Chem 15: 5811-8 (2007)


Article DOI: 10.1016/j.bmc.2007.06.002
BindingDB Entry DOI: 10.7270/Q27M07MZ
More data for this
Ligand-Target Pair