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BDBM50227786 2-(1-(3,5-dichloropyridin-4-yl)piperazine-4-carboxamido)benzoic acid::CHEMBL252507

SMILES: OC(=O)c1ccccc1NC(=O)N1CCN(CC1)c1c(Cl)cncc1Cl

InChI Key: InChIKey=FJTJOZZGBJSIHY-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50227786   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50227786
PNG
(2-(1-(3,5-dichloropyridin-4-yl)piperazine-4-carbox...)
Show SMILES OC(=O)c1ccccc1NC(=O)N1CCN(CC1)c1c(Cl)cncc1Cl
Show InChI InChI=1S/C17H16Cl2N4O3/c18-12-9-20-10-13(19)15(12)22-5-7-23(8-6-22)17(26)21-14-4-2-1-3-11(14)16(24)25/h1-4,9-10H,5-8H2,(H,21,26)(H,24,25)
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Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]niacin from human GPR109A


Bioorg Med Chem Lett 17: 6723-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.055
BindingDB Entry DOI: 10.7270/Q2R2114Q
More data for this
Ligand-Target Pair