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BDBM50301333 5-chloro-6-((2-((1-(4-chlorobenzyl)piperidin-4-yl)(methyl)amino)ethyl)(methyl)amino)-N-(3,4-dichlorobenzyl)nicotinamide::CHEMBL571815

SMILES: CN(CCN(C)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1)C1CCN(Cc2ccc(Cl)cc2)CC1

InChI Key: InChIKey=NEKOXQMHQMJFTR-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50301333   
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))		BDBM50301333
PNG
(5-chloro-6-((2-((1-(4-chlorobenzyl)piperidin-4-yl)...)
Show SMILES CN(CCN(C)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1)C1CCN(Cc2ccc(Cl)cc2)CC1
Show InChI InChI=1S/C29H33Cl4N5O/c1-36(24-9-11-38(12-10-24)19-20-3-6-23(30)7-4-20)13-14-37(2)28-27(33)16-22(18-34-28)29(39)35-17-21-5-8-25(31)26(32)15-21/h3-8,15-16,18,24H,9-14,17,19H2,1-2H3,(H,35,39)
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Similars
Article
PubMed
 2.30E+4n/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