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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cannabinoid receptor 1 | ||
| Ligand | BDBM50270539 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_552827 (CHEMBL957298) | ||
| Ki | 116±n/a nM | ||
| Citation |  Zhang, Y; Burgess, JP; Brackeen, M; Gilliam, A; Mascarella, SW; Page, K; Seltzman, HH; Thomas, BF Conformationally constrained analogues of N-(piperidinyl)-5-(4-chlorophenyl)-1-(2,4- dichlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide (SR141716): design, synthesis, computational analysis, and biological evaluations. J Med Chem51:3526-39 (2008) [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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| BDBM50270539 | |||
| n/a | |||
| Name | BDBM50270539 | ||
| Synonyms: | 5-(4-Chloro-2,6-dimethylphenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-yl-1H-pyrazole-3-carboxamide | CHEMBL478160 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H25Cl3N4O | ||
| Mol. Mass. | 491.84 | ||
| SMILES | Cc1c(nn(c1-c1c(C)cc(Cl)cc1C)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 |(6.9,-10.25,;8.05,-11.27,;9.55,-10.95,;10.33,-12.27,;9.31,-13.42,;7.89,-12.8,;6.57,-13.58,;5.23,-12.81,;5.22,-11.27,;3.9,-13.58,;3.9,-15.13,;2.56,-15.9,;5.23,-15.9,;6.57,-15.13,;6.56,-16.66,;9.63,-14.93,;8.5,-15.96,;8.82,-17.47,;10.29,-17.93,;10.61,-19.45,;11.43,-16.9,;11.1,-15.4,;12.24,-14.36,;10.17,-9.53,;9.26,-8.3,;11.7,-9.38,;12.32,-7.97,;13.86,-7.8,;14.48,-6.42,;13.58,-5.17,;12.04,-5.32,;11.41,-6.74,)| | ||
| Structure | 
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