Reaction Details Report a problem with these data
Target
C-C chemokine receptor type 2
Ligand
BDBM50316000
Substrate
n/a
Meas. Tech.
ChEMBL_625750 (CHEMBL1104427)
IC50
311.5±n/a nM
Citation
 Cherney, RJ; Mo, R; Meyer, DT; Voss, ME; Yang, MG; Santella, JB; Duncia, JV; Lo, YC; Yang, G; Miller, PB; Scherle, PA; Zhao, Q; Mandlekar, S; Cvijic, ME; Barrish, JC; Decicco, CP; Carter, PH gamma-Lactams as glycinamide replacements in cyclohexane-based CC chemokine receptor 2 (CCR2) antagonists. Bioorg Med Chem Lett 20:2425-30 (2010) [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:
BDBM50316000
Synonyms:
(+/-)-tert-butyl 2-((R)-1-((1S,2R)-2-(4-(methylthio)benzamido)cyclohexyl)-2-oxopyrrolidin-3-ylcarbamoyl)-4-(trifluoromethyl)phenylcarbamate | CHEMBL1091266
Type:
Small organic molecule
Emp. Form.:
C29H37F3N4O4S
Mol. Mass.:
594.689
SMILES:
CSc1ccc(CN[C@@H]2CCCC[C@@H]2NC(=O)CNC(=O)c2cc(ccc2NC(=O)OC(C)(C)C)C(F)(F)F)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: