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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 = 50249215   
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))
BDBM50249215
PNG
(1-(((3S,4S)-1-((R)-2-benzyl-1-cyclohexylallyl)-4-p...)
Show SMILES OC1(CCCc2ccccc2)CCN(C[C@H]2CN(C[C@@H]2c2ccccc2)[C@H](C2CCCCC2)C(=C)Cc2ccccc2)CC1
Show InChI InChI=1S/C41H54N2O/c1-33(29-35-17-8-3-9-18-35)40(37-22-12-5-13-23-37)43-31-38(39(32-43)36-20-10-4-11-21-36)30-42-27-25-41(44,26-28-42)24-14-19-34-15-6-2-7-16-34/h2-4,6-11,15-18,20-21,37-40,44H,1,5,12-14,19,22-32H2/t38-,39+,40-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.60n/an/an/an/an/an/a



Beijing University of Technology

Curated by ChEMBL


Assay Description
Displacement of [125I]MIP1alpha from human CCR5 expressed in CHO cells


Eur J Med Chem 43: 2724-34 (2008)


Article DOI: 10.1016/j.ejmech.2008.01.040
BindingDB Entry DOI: 10.7270/Q2G44Q3W
More data for this
Ligand-Target Pair