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Target
C-C motif chemokine 2
Ligand
BDBM50607767
Substrate
n/a
Meas. Tech.
ChEMBL_2263139 (CHEMBL5218150)
IC50
40±n/a nM
Citation
 Humphreys, PG; Anderson, NA; Bamborough, P; Baxter, A; Chung, CW; Cookson, R; Craggs, PD; Dalton, T; Fournier, JCL; Gordon, LJ; Gray, HF; Gray, MW; Gregory, R; Hirst, DJ; Jamieson, C; Jones, KL; Kessedjian, H; Lugo, D; McGonagle, G; Patel, VK; Patten, C; Poole, DL; Prinjha, RK; Ramirez-Molina, C; Rioja, I; Seal, G; Stafford, KAJ; Shah, RR; Tape, D; Theodoulou, NH; Tomlinson, L; Ukuser, S; Wall, ID; Wellaway, N; White, G Identification and Optimization of a Ligand-Efficient Benzoazepinone Bromodomain and Extra Terminal (BET) Family Acetyl-Lysine Mimetic into the Oral Candidate Quality Molecule I-BET432. J Med Chem 65:15174-15207 (2022) [PubMed] 
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:
BDBM50607767
Synonyms:
CHEMBL5218909
Type:
Small organic molecule
Emp. Form.:
C18H21N3O3
Mol. Mass.:
327.3776
SMILES:
C[C@@H]1c2ccc(cc2C(=CN(C)C1=O)c1cnn(C)c1)[C@H](O)CO |r,c:9|
Structure:
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