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Target
C-C motif chemokine 2
Ligand
BDBM50440544
Substrate
n/a
Meas. Tech.
ChEMBL_983389 (CHEMBL2428943)
Ki
134±n/a nM
Citation
 Vilums, M; Zweemer, AJ; Yu, Z; de Vries, H; Hillger, JM; Wapenaar, H; Bollen, IA; Barmare, F; Gross, R; Clemens, J; Krenitsky, P; Brussee, J; Stamos, D; Saunders, J; Heitman, LH; Ijzerman, AP Structure-kinetic relationships--an overlooked parameter in hit-to-lead optimization: a case of cyclopentylamines as chemokine receptor 2 antagonists. J Med Chem 56:7706-14 (2013) [PubMed]  Article 
Target
Name:
C-C motif chemokine 2
Synonyms:
CCL2 | CCL2_HUMAN | HC11 | MCAF | MCP-1 | MCP1 | Monocyte chemoattractant protein 1 | Monocyte chemotactic and activating factor | Monocyte chemotactic protein 1 | Monocyte secretory protein JE | SCYA2 | Small-inducible cytokine A2
Type:
PROTEIN
Mol. Mass.:
11032.44
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1363188
Residue:
99
Sequence:
MKVSAALLCLLLIAATFIPQGLAQPDAINAPVTCCYNFTNRKISVQRLASYRRITSSKCPKEAVIFKTIVAKEICADPKQKWVQDSMDHLDKQTQTPKT
  
Inhibitor
Name:
BDBM50440544
Synonyms:
CHEMBL2426344
Type:
Small organic molecule
Emp. Form.:
C27H32F6N2O
Mol. Mass.:
514.5462
SMILES:
CC(C)[C@@]1(CC[C@H](C1)NCCCc1ccccc1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r|
Structure:
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