Reaction Details Report a problem with these data
Target
C-C chemokine receptor type 2
Ligand
BDBM50338141
Substrate
n/a
Meas. Tech.
ChEMBL_727741 (CHEMBL1686100)
IC50
3.1±n/a nM
Citation
Trujillo, JI; Huang, W; Hughes, RO; Rogier, DJ; Turner, SR; Devraj, R; Morton, PA; Xue, CB; Chao, G; Covington, MB; Newton, RC; Metcalf, B Design and synthesis of novel CCR2 antagonists: investigation of non-aryl/heteroaryl binding motifs. Bioorg Med Chem Lett 21:1827-31 (2011) [PubMed] Article
More Info.:
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:
BDBM50338141
Synonyms:
(1S,4S)-cyclopentyl 5-((1S,3R)-3-(3-fluorotetrahydro-2H-pyran-4-ylamino)-1-isopropylcyclopentanecarbonyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate | CHEMBL1684712
Type:
Small organic molecule
Emp. Form.:
C25H40FN3O4
Mol. Mass.:
465.6012
SMILES:
CC(C)[C@@]1(CC[C@H](C1)NC1CCOCC1F)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)OC1CCCC1 |r|