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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 50265086   
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 2


(Homo sapiens (Human))
BDBM50265086
PNG
((+/-)-2-amino-N-(2-(1-methyl-4-(4-(methylthio)benz...)
Show SMILES CSc1ccc(CNC2CCN(C)CC2NC(=O)CNC(=O)c2cc(ccc2N)C(F)(F)F)cc1
Show InChI InChI=1S/C24H30F3N5O2S/c1-32-10-9-20(29-12-15-3-6-17(35-2)7-4-15)21(14-32)31-22(33)13-30-23(34)18-11-16(24(25,26)27)5-8-19(18)28/h3-8,11,20-21,29H,9-10,12-14,28H2,1-2H3,(H,30,34)(H,31,33)
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UniProtKB/SwissProt

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PC cid
PC sid
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Article
PubMed
n/an/a 0.950n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Displacement of radiolabeled MCP1 from CCR2 in human PBMC by millipore filter plate assay


Bioorg Med Chem Lett 18: 5063-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.123
BindingDB Entry DOI: 10.7270/Q23N236S
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50265086
PNG
((+/-)-2-amino-N-(2-(1-methyl-4-(4-(methylthio)benz...)
Show SMILES CSc1ccc(CNC2CCN(C)CC2NC(=O)CNC(=O)c2cc(ccc2N)C(F)(F)F)cc1
Show InChI InChI=1S/C24H30F3N5O2S/c1-32-10-9-20(29-12-15-3-6-17(35-2)7-4-15)21(14-32)31-22(33)13-30-23(34)18-11-16(24(25,26)27)5-8-19(18)28/h3-8,11,20-21,29H,9-10,12-14,28H2,1-2H3,(H,30,34)(H,31,33)
PDB

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UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Antagonist activity at CCR2 in human PBMC assessed as MCP1-induced calcium flux by fluorescence-imaging plate assay


Bioorg Med Chem Lett 18: 5063-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.123
BindingDB Entry DOI: 10.7270/Q23N236S
More data for this
Ligand-Target Pair
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50265086
PNG
((+/-)-2-amino-N-(2-(1-methyl-4-(4-(methylthio)benz...)
Show SMILES CSc1ccc(CNC2CCN(C)CC2NC(=O)CNC(=O)c2cc(ccc2N)C(F)(F)F)cc1
Show InChI InChI=1S/C24H30F3N5O2S/c1-32-10-9-20(29-12-15-3-6-17(35-2)7-4-15)21(14-32)31-22(33)13-30-23(34)18-11-16(24(25,26)27)5-8-19(18)28/h3-8,11,20-21,29H,9-10,12-14,28H2,1-2H3,(H,30,34)(H,31,33)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 27.5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Antagonist activity at CCR2 in human PBMC assessed as MCP1-induced chemotaxis


Bioorg Med Chem Lett 18: 5063-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.123
BindingDB Entry DOI: 10.7270/Q23N236S
More data for this
Ligand-Target Pair