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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 = 'BDBM50133917'   
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))
BDBM50133917
PNG
(((6S,7R)-6-Methyl-6,7,8,9-tetrahydro-naphtho[1,2-b...)
Show SMILES CCCN(CCC)[C@@H]1CCc2c(ccc3ccoc23)[C@@H]1C
Show InChI InChI=1S/C19H27NO/c1-4-11-20(12-5-2)18-9-8-17-16(14(18)3)7-6-15-10-13-21-19(15)17/h6-7,10,13-14,18H,4-5,8-9,11-12H2,1-3H3/t14-,18+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
27n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Compound was measured for its ability to compete with [3H]spiperone binding to the human Dopamine receptor D3 transfected in CHO cells


J Med Chem 46: 4377-92 (2003)


Article DOI: 10.1021/jm030085p
BindingDB Entry DOI: 10.7270/Q21V5FPS
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50133917
PNG
(((6S,7R)-6-Methyl-6,7,8,9-tetrahydro-naphtho[1,2-b...)
Show SMILES CCCN(CCC)[C@@H]1CCc2c(ccc3ccoc23)[C@@H]1C
Show InChI InChI=1S/C19H27NO/c1-4-11-20(12-5-2)18-9-8-17-16(14(18)3)7-6-15-10-13-21-19(15)17/h6-7,10,13-14,18H,4-5,8-9,11-12H2,1-3H3/t14-,18+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
27n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested in vitro for the inhibition of [3H]-U-86,170 binding to Dopamine receptor D3, expressed in cloned CHO cells


Bioorg Med Chem Lett 7: 2759-2764 (1997)


Article DOI: 10.1016/S0960-894X(97)10068-3
BindingDB Entry DOI: 10.7270/Q2F47P56
More data for this
Ligand-Target Pair