Reaction Details | |||
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Target | C-C chemokine receptor type 2 | ||
Ligand | BDBM50359126 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_789638 (CHEMBL1924723) | ||
IC50 | 980±n/a nM | ||
Citation | Lanter, JC; Markotan, TP; Zhang, X; Subasinghe, N; Kang, FA; Hou, C; Singer, M; Opas, E; McKenney, S; Crysler, C; Johnson, D; Molloy, CJ; Sui, Z The discovery of novel cyclohexylamide CCR2 antagonists. Bioorg Med Chem Lett21:7496-501 (2011) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
C-C chemokine receptor type 2 | |||
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: |
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BDBM50359126 | |||
n/a | |||
Name | BDBM50359126 | ||
Synonyms: | CHEMBL1922790 | ||
Type | Small organic molecule | ||
Emp. Form. | C31H35F3N4O2 | ||
Mol. Mass. | 552.6304 | ||
SMILES | CNC(=O)C(NC1CCC(CC1)c1c[nH]c2ccccc12)C1CCN(CC1)C(=O)\C=C\c1cc(F)c(F)c(F)c1 |(-8.01,-39.15,;-6.67,-38.38,;-5.34,-39.16,;-4.01,-38.39,;-5.35,-40.7,;-6.68,-41.46,;-6.68,-43,;-8.02,-43.77,;-8.03,-45.3,;-6.7,-46.08,;-5.36,-45.31,;-5.35,-43.76,;-6.7,-47.62,;-7.95,-48.53,;-7.46,-49.99,;-5.93,-49.98,;-4.9,-51.12,;-3.4,-50.8,;-2.93,-49.33,;-3.96,-48.19,;-5.45,-48.52,;-4.02,-41.47,;-4.03,-43.01,;-2.71,-43.79,;-1.37,-43.03,;-1.36,-41.49,;-2.69,-40.7,;-.04,-43.81,;-.05,-45.35,;1.3,-43.04,;2.63,-43.82,;3.97,-43.06,;3.97,-41.53,;5.3,-40.77,;5.31,-39.23,;6.64,-41.55,;7.98,-40.78,;6.63,-43.09,;7.96,-43.87,;5.29,-43.85,)| | ||
Structure |