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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'DOPAMINE' and Ligand = 'BDBM50022054'   
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
DOPAMINE


(RAT)
BDBM50022054
PNG
(7-Chloro-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-6...)
Show SMILES Oc1cc2C(CNCc2cc1Cl)c1ccccc1
Show InChI InChI=1S/C15H14ClNO/c16-14-6-11-8-17-9-13(12(11)7-15(14)18)10-4-2-1-3-5-10/h1-7,13,17-18H,8-9H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
565n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Binding affinity towards dopamine receptor D1 using [3H]-SCH-23,390 was determined in rat striatal membranes


J Med Chem 37: 4317-28 (1995)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2NC607Q
More data for this
Ligand-Target Pair
DOPAMINE


(RAT)
BDBM50022054
PNG
(7-Chloro-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-6...)
Show SMILES Oc1cc2C(CNCc2cc1Cl)c1ccccc1
Show InChI InChI=1S/C15H14ClNO/c16-14-6-11-8-17-9-13(12(11)7-15(14)18)10-4-2-1-3-5-10/h1-7,13,17-18H,8-9H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
565n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of [3H]SCH-23,390 binding to Dopamine receptor D1 at 0.25 nM


J Med Chem 31: 1941-6 (1988)


BindingDB Entry DOI: 10.7270/Q20002PD
More data for this
Ligand-Target Pair
DOPAMINE


(RAT)
BDBM50022054
PNG
(7-Chloro-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-6...)
Show SMILES Oc1cc2C(CNCc2cc1Cl)c1ccccc1
Show InChI InChI=1S/C15H14ClNO/c16-14-6-11-8-17-9-13(12(11)7-15(14)18)10-4-2-1-3-5-10/h1-7,13,17-18H,8-9H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
3.62E+3n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Binding affinity towards dopamine (D1) receptor using [3H]-spiperone was determined in rat striatal membranes


J Med Chem 37: 4317-28 (1995)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2NC607Q
More data for this
Ligand-Target Pair