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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 = 'BDBM50401954'   
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))
BDBM50401954
PNG
(CHEMBL2207636)
Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1
Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
8.30n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D2long receptor expressed in CHO cells after 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 22: 7151-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.064
BindingDB Entry DOI: 10.7270/Q2Q52QSM
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50401954
PNG
(CHEMBL2207636)
Show SMILES COc1ccccc1N1CCN(Cc2cc(C#N)c3cccccc23)CC1
Show InChI InChI=1S/C23H23N3O/c1-27-23-10-6-5-9-22(23)26-13-11-25(12-14-26)17-19-15-18(16-24)20-7-3-2-4-8-21(19)20/h2-10,15H,11-14,17H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
39n/an/an/an/an/an/an/an/a



Friedrich Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D2short receptor expressed in CHO cells after 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 22: 7151-4 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.064
BindingDB Entry DOI: 10.7270/Q2Q52QSM
More data for this
Ligand-Target Pair