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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 = 50321722   
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))
BDBM50321722
PNG
(CHEMBL1169745 | N-((S)-1-(4-(trifluoromethyl)pheny...)
Show SMILES CC(C)N(C(C)=O)c1ccc(cc1)N1CCN(CC[C@H](NC(=O)C2CCCCC2)c2ccc(cc2)C(F)(F)F)CC1
Show InChI InChI=1/C32H43F3N4O2/c1-23(2)39(24(3)40)29-15-13-28(14-16-29)38-21-19-37(20-22-38)18-17-30(36-31(41)26-7-5-4-6-8-26)25-9-11-27(12-10-25)32(33,34)35/h9-16,23,26,30H,4-8,17-22H2,1-3H3,(H,36,41)/t30-/s2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Institute of Materia Medica

Curated by ChEMBL


Assay Description
Antagonist activity at CCR5 expressed in CHO cells assessed as inhibition of RANTES-stimulated GTPgammaS binding by scintillation proximity assay


Eur J Med Chem 45: 2827-40 (2010)


Article DOI: 10.1016/j.ejmech.2010.03.003
BindingDB Entry DOI: 10.7270/Q2FB5341
More data for this
Ligand-Target Pair