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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 = 'BDBM50187683'   
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


(Rattus norvegicus (rat))
BDBM50187683
PNG
(CHEMBL1186488)
Show SMILES COc1cc(CCN(C)C)c2ccc3ccccc3c2c1OC
Show InChI InChI=1S/C20H23NO2/c1-21(2)12-11-15-13-18(22-3)20(23-4)19-16-8-6-5-7-14(16)9-10-17(15)19/h5-10,13H,11-12H2,1-4H3
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CHEMBL
MCE
PC cid
PC sid
UniChem

Similars

Article
PubMed
321n/an/an/an/an/an/an/an/a



Universidad de Valencia

Curated by ChEMBL


Assay Description
Displacement of [3H]-raclopride from D2 receptor of Wistar rat striatal membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem Lett 23: 4824-7 (2013)


Article DOI: 10.1016/j.bmcl.2013.06.078
BindingDB Entry DOI: 10.7270/Q2BK1G9S
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50187683
PNG
(CHEMBL1186488)
Show SMILES COc1cc(CCN(C)C)c2ccc3ccccc3c2c1OC
Show InChI InChI=1S/C20H23NO2/c1-21(2)12-11-15-13-18(22-3)20(23-4)19-16-8-6-5-7-14(16)9-10-17(15)19/h5-10,13H,11-12H2,1-4H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Similars

Article
PubMed
323n/an/an/an/an/an/an/an/a



Universidad de Valencia

Curated by ChEMBL


Assay Description
Displacement of [3H]-raclopride from D2 receptor of Wistar rat striatal membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem Lett 23: 4824-7 (2013)


Article DOI: 10.1016/j.bmcl.2013.06.078
BindingDB Entry DOI: 10.7270/Q2BK1G9S
More data for this
Ligand-Target Pair