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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'D(1A) dopamine receptor' and Ligand = 'BDBM50493351'   
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(1A) dopamine receptor


(RAT)
BDBM50493351
PNG
(CHEMBL2425374)
Show SMILES COc1cccc2CC3N(CCc4cc(OC)c(OC)cc34)Cc12
Show InChI InChI=1S/C20H23NO3/c1-22-18-6-4-5-13-9-17-15-11-20(24-3)19(23-2)10-14(15)7-8-21(17)12-16(13)18/h4-6,10-11,17H,7-9,12H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.63E+3n/an/an/an/an/an/an/an/a



Universidad de Valencia

Curated by ChEMBL


Assay Description
Displacement of [3H]-SCH 23390 from dopamine D1 receptor in rat striatal membranes after 1 hr by liquid scintillation counting analysis


Eur J Med Chem 68: 150-66 (2013)


Article DOI: 10.1016/j.ejmech.2013.07.036
BindingDB Entry DOI: 10.7270/Q2J1063R
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50493351
PNG
(CHEMBL2425374)
Show SMILES COc1cccc2CC3N(CCc4cc(OC)c(OC)cc34)Cc12
Show InChI InChI=1S/C20H23NO3/c1-22-18-6-4-5-13-9-17-15-11-20(24-3)19(23-2)10-14(15)7-8-21(17)12-16(13)18/h4-6,10-11,17H,7-9,12H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.93E+3n/an/an/an/an/an/an/an/a



Universidad de Valencia

Curated by ChEMBL


Assay Description
Displacement of [3H]-SCH 23390 from dopamine D1 receptor in rat striatal membranes after 1 hr by liquid scintillation counting analysis


Eur J Med Chem 68: 150-66 (2013)


Article DOI: 10.1016/j.ejmech.2013.07.036
BindingDB Entry DOI: 10.7270/Q2J1063R
More data for this
Ligand-Target Pair