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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 = 'BDBM50276633'   
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))		BDBM50276633
PNG
(CHEMBL456425 | N-((1S)-3-(4-(N-ethyl-2-methyl-2-ph...)
Show SMILES CCN(C1CCN(CC1)C(C)C[C@H](NC(=O)C1CCC1)c1ccccc1)C(=O)C(C)(C)c1ccccc1 |r|
Show InChI InChI=1S/C32H45N3O2/c1-5-35(31(37)32(3,4)27-17-10-7-11-18-27)28-19-21-34(22-20-28)24(2)23-29(25-13-8-6-9-14-25)33-30(36)26-15-12-16-26/h6-11,13-14,17-18,24,26,28-29H,5,12,15-16,19-23H2,1-4H3,(H,33,36)/t24?,29-/m0/s1
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Similars
Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant CCR5 expressed in human HeLa-P4 cells assessed as inhibition of human HeLa-P4 cells binding to HIV1 gp160 ex...

Bioorg Med Chem Lett 19: 1075-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.009
BindingDB Entry DOI: 10.7270/Q27M08VH
More data for this
Ligand-Target Pair