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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 = 'BDBM50010598'   
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)
BDBM50010598
PNG
(1-Methyl-4-(5-methylene-5H-dibenzo[a,d]cyclohepten...)
Show SMILES CN1CCN(CC1)C1=Cc2ccccc2C(=C)c2ccccc12 |t:8|
Show InChI InChI=1S/C21H22N2/c1-16-18-8-4-3-7-17(18)15-21(20-10-6-5-9-19(16)20)23-13-11-22(2)12-14-23/h3-10,15H,1,11-14H2,2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.70n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity of the compound was evaluated as inhibition constant for dopamine receptor D1 using [3H]-SCH- 23390 as radioligand


J Med Chem 37: 2686-96 (1994)


BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50010598
PNG
(1-Methyl-4-(5-methylene-5H-dibenzo[a,d]cyclohepten...)
Show SMILES CN1CCN(CC1)C1=Cc2ccccc2C(=C)c2ccccc12 |t:8|
Show InChI InChI=1S/C21H22N2/c1-16-18-8-4-3-7-17(18)15-21(20-10-6-5-9-19(16)20)23-13-11-22(2)12-14-23/h3-10,15H,1,11-14H2,2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 21n/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Binding affinity against Dopamine receptor D1 using [3H]-SCN 23390 in rat brain


J Med Chem 33: 809-14 (1990)


BindingDB Entry DOI: 10.7270/Q2348JCH
More data for this
Ligand-Target Pair