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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-X-C chemokine receptor type 4' and Ligand = 'BDBM50337573'   
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
C-X-C chemokine receptor type 4


(Homo sapiens (Human))		BDBM50337573
PNG
(CHEMBL1682866 | racN1-(3-chloropyridin-2-ylmethyl)...)
Show SMILES NCCCCN(Cc1ncccc1Cl)C1CCCc2cccnc12
Show InChI InChI=1S/C19H25ClN4/c20-16-8-5-11-22-17(16)14-24(13-2-1-10-21)18-9-3-6-15-7-4-12-23-19(15)18/h4-5,7-8,11-12,18H,1-3,6,9-10,13-14,21H2
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Article
PubMed
n/an/a 44n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Antagonist activity at CXCR4 in human CEM-CCRF cells assessed as inhibition of SDF-1-induced calcium signaling

Bioorg Med Chem Lett 21: 1414-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.021
BindingDB Entry DOI: 10.7270/Q2FT8M9F
More data for this
Ligand-Target Pair