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BDBM50359114 CHEMBL1921811

SMILES: NC(=O)C(NC1CCP(=O)(CC1)c1ccccc1)C1CCN(CC1)C(=O)\C=C\c1cc(F)c(F)c(F)c1

InChI Key: InChIKey=LDEBIWOXDWVGAS-VOTSOKGWSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50359114   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50359114
PNG
(CHEMBL1921811)
Show SMILES NC(=O)C(NC1CCP(=O)(CC1)c1ccccc1)C1CCN(CC1)C(=O)\C=C\c1cc(F)c(F)c(F)c1
Show InChI InChI=1S/C27H31F3N3O3P/c28-22-16-18(17-23(29)25(22)30)6-7-24(34)33-12-8-19(9-13-33)26(27(31)35)32-20-10-14-37(36,15-11-20)21-4-2-1-3-5-21/h1-7,16-17,19-20,26,32H,8-15H2,(H2,31,35)/b7-6+
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human CCR2


Bioorg Med Chem Lett 21: 7496-501 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.113
BindingDB Entry DOI: 10.7270/Q22J6C9M
More data for this
Ligand-Target Pair