Reaction Details Report a problem with these data
Target
C-C chemokine receptor type 2
Ligand
BDBM50098054
Substrate
n/a
Meas. Tech.
ChEMBL_1502264 (CHEMBL3591343)
IC50
353±n/a nM
Citation
 Strunz, AK; Zweemer, AJ; Weiss, C; Schepmann, D; Junker, A; Heitman, LH; Koch, M; Wünsch, B Synthesis and biological evaluation of spirocyclic antagonists of CCR2 (chemokine CC receptor subtype 2). Bioorg Med Chem 23:4034-49 (2015) [PubMed]  Article 
Target
Name:
C-C chemokine receptor type 2
Synonyms:
C-C chemokine receptor type 2 (CCR2) | CCR2 | CCR2_HUMAN | CMKBR2 | Chemoattractant Cytokine Receptor 2 (CCR2) | Chemokine Receptor Type 2b (CCR2b) | Monocyte chemotactic protein-1 (MCP-1)
Type:
Enzyme
Mol. Mass.:
41932.32
Organism:
Homo sapiens (Human)
Description:
P41597
Residue:
374
Sequence:
MLSTSRSRFIRNTNESGEEVTTFFDYDYGAPCHKFDVKQIGAQLLPPLYSLVFIFGFVGNMLVVLILINCKKLKCLTDIYLLNLAISDLLFLITLPLWAHSAANEWVFGNAMCKLFTGLYHIGYFGGIFFIILLTIDRYLAIVHAVFALKARTVTFGVVTSVITWLVAVFASVPGIIFTKCQKEDSVYVCGPYFPRGWNNFHTIMRNILGLVLPLLIMVICYSGILKTLLRCRNEKKRHRAVRVIFTIMIVYFLFWTPYNIVILLNTFQEFFGLSNCESTSQLDQATQVTETLGMTHCCINPIIYAFVGEKFRSLFHIALGCRIAPLQKPVCGGPGVRPGKNVKVTTQGLLDGRGKGKSIGRAPEASLQDKEGA
  
Inhibitor
Name:
BDBM50098054
Synonyms:
CHEMBL3589950
Type:
Small organic molecule
Emp. Form.:
C32H33F5N2O3
Mol. Mass.:
588.608
SMILES:
COc1ccc2c(CCOC22CCN(CCC(C(=O)NCc3cc(F)cc(c3)C(F)(F)F)c3ccc(F)cc3)CC2)c1
Structure:
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