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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 5' and Ligand = 'BDBM50096546'   
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-C chemokine receptor type 5


(Homo sapiens (Human))		BDBM50096546
PNG
(CHEMBL420242 | N-[2-(2-Chloro-phenyl)-4-(4-phenyl-...)
Show SMILES CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccccc1Cl)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H33ClN2O2S/c1-30(34(32,33)26-12-6-3-7-13-26)22-25(27-14-8-9-15-28(27)29)18-21-31-19-16-24(17-20-31)23-10-4-2-5-11-23/h2-15,24-25H,16-22H2,1H3
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KEGG

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PC cid
PC sid
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Similars
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against specific binding of [125I]-MIP-1 alpha to human CCR5 receptor.

Bioorg Med Chem Lett 11: 265-70 (2001)


BindingDB Entry DOI: 10.7270/Q2668CFZ
More data for this
Ligand-Target Pair