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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50010292   
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))
BDBM50010292
PNG
(8-[4-(4-Fluoro-phenyl)-4-oxo-butyl]-3-{2-[4-(7-nit...)
Show SMILES [O-][N+](=O)c1ccc(Nc2ccc(CCN3CN(c4ccccc4)C4(CCN(CCCC(=O)c5ccc(F)cc5)CC4)C3=O)cc2)c2[n-][o+]nc12
Show InChI InChI=1S/C37H36FN7O5/c38-28-12-10-27(11-13-28)33(46)7-4-21-42-23-19-37(20-24-42)36(47)43(25-44(37)30-5-2-1-3-6-30)22-18-26-8-14-29(15-9-26)39-31-16-17-32(45(48)49)35-34(31)40-50-41-35/h1-3,5-6,8-17,39H,4,7,18-25H2
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PC cid
PC sid
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PubMed
0.660n/an/an/an/an/an/an/an/a



Research Biochemicals Inc.

Curated by ChEMBL


Assay Description
Binding affinity against dopamine receptor D2 by using [3H]spiperone as radioligand in caudate-putamen of monkey


J Med Chem 34: 3235-41 (1991)


BindingDB Entry DOI: 10.7270/Q2KS6S5V
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50010292
PNG
(8-[4-(4-Fluoro-phenyl)-4-oxo-butyl]-3-{2-[4-(7-nit...)
Show SMILES [O-][N+](=O)c1ccc(Nc2ccc(CCN3CN(c4ccccc4)C4(CCN(CCCC(=O)c5ccc(F)cc5)CC4)C3=O)cc2)c2[n-][o+]nc12
Show InChI InChI=1S/C37H36FN7O5/c38-28-12-10-27(11-13-28)33(46)7-4-21-42-23-19-37(20-24-42)36(47)43(25-44(37)30-5-2-1-3-6-30)22-18-26-8-14-29(15-9-26)39-31-16-17-32(45(48)49)35-34(31)40-50-41-35/h1-3,5-6,8-17,39H,4,7,18-25H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
99n/an/an/an/an/an/an/an/a



Research Biochemicals Inc.

Curated by ChEMBL


Assay Description
Binding affinity against dopamine receptor D1 by using [3H]-SCH- 23390 as radioligand in caudate-putamen of monkey


J Med Chem 34: 3235-41 (1991)


BindingDB Entry DOI: 10.7270/Q2KS6S5V
More data for this
Ligand-Target Pair