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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 Monomerid = 50148677   
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))
BDBM50148677
PNG
(Allyl-[1-(5-benzenesulfonyl-3-phenyl-heptyl)-piper...)
Show SMILES CCC(CC(CCN1CCC(CC1)N(CC=C)C(=O)OCc1ccc(cc1)[N+]([O-])=O)c1ccccc1)S(=O)(=O)c1ccccc1
Show InChI InChI=1/C35H43N3O6S/c1-3-22-37(35(39)44-27-28-15-17-32(18-16-28)38(40)41)31-20-24-36(25-21-31)23-19-30(29-11-7-5-8-12-29)26-33(4-2)45(42,43)34-13-9-6-10-14-34/h3,5-18,30-31,33H,1,4,19-27H2,2H3
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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 7.20E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit [125I]-MIP-1 alpha binding to C-C chemokine receptor type 5


Bioorg Med Chem Lett 14: 3589-93 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.112
BindingDB Entry DOI: 10.7270/Q20001KN
More data for this
Ligand-Target Pair