Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | C-C chemokine receptor type 1 | ||
| Ligand | BDBM50098627 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_218695 (CHEMBL821481) | ||
| IC50 | 240±n/a nM | ||
| Citation |  Naya, A; Sagara, Y; Ohwaki, K; Saeki, T; Ichikawa, D; Iwasawa, Y; Noguchi, K; Ohtake, N Design, synthesis, and discovery of a novel CCR1 antagonist. J Med Chem44:1429-35 (2001) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| C-C chemokine receptor type 1 | |||
| Name: | C-C chemokine receptor type 1 | ||
| Synonyms: | C-C CKR-1 | CC-CKR-1 | CCR-1 | CCR1_MOUSE | CD_antigen=CD191 | Ccr1 | Cmkbr1 | MIP-1alpha-R | Macrophage inflammatory protein 1-alpha receptor | RANTES-R | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 40904.59 | ||
| Organism: | Mus musculus | ||
| Description: | ChEMBL_1452291 | ||
| Residue: | 355 | ||
| Sequence: |
| ||
| BDBM50098627 | |||
| n/a | |||
| Name | BDBM50098627 | ||
| Synonyms: | 1-Cyclooctylmethyl-4-[(2,7-dibromo-9H-xanthene-9-carbonyl)-amino]-1-methyl-piperidinium; iodide | CHEMBL33223 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C29H37Br2N2O2 | ||
| Mol. Mass. | 605.424 | ||
| SMILES | C[N+]1(CC2CCCCCCC2)CCC(CC1)NC(=O)C1c2cc(Br)ccc2Oc2ccc(Br)cc12 |(8.73,-24.46,;8.74,-26,;10.08,-26.77,;11.65,-26.09,;11.05,-24.67,;11.65,-23.24,;13.07,-22.65,;14.48,-23.24,;15.08,-24.67,;14.48,-26.08,;13.07,-26.67,;7.39,-25.26,;6.07,-26,;6.07,-27.54,;7.42,-28.31,;8.77,-27.54,;4.75,-28.31,;3.41,-27.54,;3.4,-26,;2.1,-28.31,;.77,-27.54,;.77,-26,;-.57,-25.23,;-.58,-23.69,;-1.91,-26,;-1.89,-27.56,;-.58,-28.31,;-.6,-29.85,;.75,-30.62,;.74,-32.13,;2.06,-32.93,;3.41,-32.16,;4.89,-32.56,;3.41,-30.64,;2.1,-29.85,)| | ||
| Structure | 
| ||