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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 = 'BDBM50124960'   
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))
BDBM50124960
PNG
((4-{(4-Bromo-phenyl)-[(E)-cyclopropylmethoxyimino]...)
Show SMILES Cc1ncnc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)C(=N/OCC1CC1)\c1ccc(Br)cc1
Show InChI InChI=1S/C29H38BrN5O2/c1-20-26(21(2)32-19-31-20)28(36)34-16-12-29(3,13-17-34)35-14-10-24(11-15-35)27(33-37-18-22-4-5-22)23-6-8-25(30)9-7-23/h6-9,19,22,24H,4-5,10-18H2,1-3H3/b33-27-
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Lindsley F. Kimball Research Institute of The New York Blood Center

Curated by ChEMBL


Assay Description
Inhibition of RANTES binding to the human C-C chemokine receptor type 5 (CCR5)


J Med Chem 46: 4501-15 (2003)


Article DOI: 10.1021/jm030265z
BindingDB Entry DOI: 10.7270/Q2SB46GG
More data for this
Ligand-Target Pair
C-C chemokine receptor type 5


(Homo sapiens (Human))
BDBM50124960
PNG
((4-{(4-Bromo-phenyl)-[(E)-cyclopropylmethoxyimino]...)
Show SMILES Cc1ncnc(C)c1C(=O)N1CCC(C)(CC1)N1CCC(CC1)C(=N/OCC1CC1)\c1ccc(Br)cc1
Show InChI InChI=1S/C29H38BrN5O2/c1-20-26(21(2)32-19-31-20)28(36)34-16-12-29(3,13-17-34)35-14-10-24(11-15-35)27(33-37-18-22-4-5-22)23-6-8-25(30)9-7-23/h6-9,19,22,24H,4-5,10-18H2,1-3H3/b33-27-
PDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
11n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibition of [125I]RANTES binding to CCR5 receptor.


Bioorg Med Chem Lett 13: 709-12 (2003)


BindingDB Entry DOI: 10.7270/Q2VM4CTD
More data for this
Ligand-Target Pair