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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cannabinoid receptor 1 | ||
| Ligand | BDBM50243610 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1672800 (CHEMBL4022829) | ||
| Ki | 0.398107±n/a nM | ||
| Citation |  Xia, L; de Vries, H; Lenselink, EB; Louvel, J; Waring, MJ; Cheng, L; Pahlén, S; Petersson, MJ; Schell, P; Olsson, RI; Heitman, LH; Sheppard, RJ; IJzerman, AP Structure-Affinity Relationships and Structure-Kinetic Relationships of 1,2-Diarylimidazol-4-carboxamide Derivatives as Human Cannabinoid 1 Receptor Antagonists. J Med Chem60:9545-9564 (2017) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Cannabinoid receptor 1 | |||
| Name: | Cannabinoid receptor 1 | ||
| Synonyms: | CANN6 | CANNABINOID CB1 | CB-R | CB1 | CNR | CNR1 | CNR1_HUMAN | Cannabinoid CB1 receptor | Cannabinoid receptor | Cannabinoid receptor 1 (CB1) | Cannabinoid receptor 1 (brain) | ||
| Type: | G Protein-Coupled Receptor (GPCR) | ||
| Mol. Mass.: | 52868.96 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P21554 | ||
| Residue: | 472 | ||
| Sequence: |
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| BDBM50243610 | |||
| n/a | |||
| Name | BDBM50243610 | ||
| Synonyms: | CHEMBL4063825 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H26Cl2F3N3O5S | ||
| Mol. Mass. | 620.468 | ||
| SMILES | Cc1c(nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(OS(=O)(=O)CCC(F)(F)F)cc1)C(=O)NC1CCC(O)CC1 |(15.34,-28.63,;14.39,-27.41,;14.83,-25.94,;13.55,-25.07,;12.33,-26.04,;10.8,-25.86,;9.88,-27.09,;8.35,-26.92,;7.73,-25.49,;6.2,-25.31,;8.66,-24.25,;10.19,-24.43,;11.12,-23.2,;12.86,-27.46,;11.94,-28.69,;10.41,-28.5,;9.49,-29.73,;10.07,-31.16,;9.12,-32.41,;7.58,-32.4,;6.24,-31.63,;7.58,-30.86,;6.81,-33.73,;5.27,-33.72,;4.49,-35.05,;2.95,-35.05,;5.26,-36.39,;3.71,-36.38,;11.61,-31.36,;12.54,-30.12,;16.32,-25.57,;17.38,-26.68,;16.74,-24.09,;18.24,-23.72,;19.31,-24.82,;20.8,-24.45,;21.22,-22.98,;22.72,-22.62,;20.16,-21.87,;18.67,-22.23,)| | ||
| Structure | 
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