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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50260634'   
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


(Homo sapiens (Human))
BDBM50260634
PNG
(CHEMBL4084663)
Show SMILES Cc1nc2C(=O)CCCn2c(=O)c1CCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C22H25N5O2S/c1-15-16(22(29)27-9-4-6-18(28)21(27)23-15)8-10-25-11-13-26(14-12-25)20-17-5-2-3-7-19(17)30-24-20/h2-3,5,7H,4,6,8-14H2,1H3
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.60n/an/an/an/an/an/a



Xinjiang Technical Institute of Physics and Chemistry

Curated by ChEMBL


Assay Description
Antagonist activity at dopamine D2 receptor (unknown origin) after 60 mins by Ultra lance cAMP assay


Bioorg Med Chem 25: 4904-4916 (2017)


Article DOI: 10.1016/j.bmc.2017.07.040
BindingDB Entry DOI: 10.7270/Q2Z3222T
More data for this
Ligand-Target Pair