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BDBM50301337 5-chloro-6-(4-(1-(3-cyanobenzyl)piperidin-4-yl)piperazin-1-yl)-N-(2-phenoxyethyl)nicotinamide::CHEMBL587391

SMILES: Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2cccc(c2)C#N)CC1)C(=O)NCCOc1ccccc1

InChI Key: InChIKey=LVVBVRIOZJNFCS-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50301337   
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
chemokine (C-X-C motif) receptor 3


(Homo sapiens (Human))		BDBM50301337
PNG
(5-chloro-6-(4-(1-(3-cyanobenzyl)piperidin-4-yl)pip...)
Show SMILES Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2cccc(c2)C#N)CC1)C(=O)NCCOc1ccccc1
Show InChI InChI=1S/C31H35ClN6O2/c32-29-20-26(31(39)34-11-18-40-28-7-2-1-3-8-28)22-35-30(29)38-16-14-37(15-17-38)27-9-12-36(13-10-27)23-25-6-4-5-24(19-25)21-33/h1-8,19-20,22,27H,9-18,23H2,(H,34,39)
UniProtKB/SwissProt

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Similars
Article
PubMed
 4.10E+3n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of 125I-IP10 from recombinant human CXCR3 receptor expressed in Ba/F3 cell membrane after 1 to 4 hrs by scintillation counting

Bioorg Med Chem Lett 19: 5205-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.020
BindingDB Entry DOI: 10.7270/Q21V5F18
More data for this
Ligand-Target Pair