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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 = 'BDBM50248266'   
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))		BDBM50248266
PNG
((+/-)-3,3,3-trifluoro-N-((1S)-3-(4-(3-isopropyl-5-...)
Show SMILES CC(C)c1nnc(C)n1C1CCN(CC1)C(C)C[C@H](NC(=O)CC(F)(F)F)c1ccccc1 |r|
Show InChI InChI=1S/C24H34F3N5O/c1-16(2)23-30-29-18(4)32(23)20-10-12-31(13-11-20)17(3)14-21(19-8-6-5-7-9-19)28-22(33)15-24(25,26)27/h5-9,16-17,20-21H,10-15H2,1-4H3,(H,28,33)/t17?,21-/m0/s1
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a 85.3n/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: 1499-503 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.008
BindingDB Entry DOI: 10.7270/Q2PN96JF
More data for this
Ligand-Target Pair