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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 5' and Ligand = 'BDBM50197791'   
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))
BDBM50197791
PNG
((2E)-2-[2-(benzyloxy)-5-bromobenzylidene]hydrazine...)
Show SMILES [#7]\[#6](-[#7])=[#7]\[#7]=[#6]-c1cc(Br)ccc1-[#8]-[#6]-c1ccccc1 |w:5.5|
Show InChI InChI=1S/C15H15BrN4O/c16-13-6-7-14(12(8-13)9-19-20-15(17)18)21-10-11-4-2-1-3-5-11/h1-9H,10H2,(H4,17,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I]MIP1alpha from human CCR5/CD4 expressed in HEK293 cells


Bioorg Med Chem Lett 17: 231-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.052
BindingDB Entry DOI: 10.7270/Q2FQ9W8N
More data for this
Ligand-Target Pair
C-C chemokine receptor type 5


(Homo sapiens (Human))
BDBM50197791
PNG
((2E)-2-[2-(benzyloxy)-5-bromobenzylidene]hydrazine...)
Show SMILES [#7]\[#6](-[#7])=[#7]\[#7]=[#6]-c1cc(Br)ccc1-[#8]-[#6]-c1ccccc1 |w:5.5|
Show InChI InChI=1S/C15H15BrN4O/c16-13-6-7-14(12(8-13)9-19-20-15(17)18)21-10-11-4-2-1-3-5-11/h1-9H,10H2,(H4,17,18,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 1.90E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at Homo sapiens (human) CCR5 receptor


Citation and Details

Article DOI: 10.1007/s00044-012-0118-7
BindingDB Entry DOI: 10.7270/Q24J0J1F
More data for this
Ligand-Target Pair