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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cannabinoid receptor 1 | ||
| Ligand | BDBM50298952 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_588141 (CHEMBL1049258) | ||
| Ki | 112±n/a nM | ||
| Citation |  Silvestri, R; Ligresti, A; La Regina, G; Piscitelli, F; Gatti, V; Brizzi, A; Pasquini, S; Lavecchia, A; Allarà, M; Fantini, N; Carai, MA; Novellino, E; Colombo, G; Di Marzo, V; Corelli, F Synthesis, cannabinoid receptor affinity, molecular modeling studies and in vivo pharmacological evaluation of new substituted 1-aryl-5-(1H-pyrrol-1-yl)-1H-pyrazole-3-carboxamides. 2. Effect of the 3-carboxamide substituent on the affinity and selectivity profile. Bioorg Med Chem17:5549-64 (2009) [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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| BDBM50298952 | |||
| n/a | |||
| Name | BDBM50298952 | ||
| Synonyms: | CHEMBL573796 | N-[2-(3-Chloro-4-methoxyphenyl)ethyl]1-(2,4-dichlorophenyl)-5-(2,5-dimethyl-1H-pyrrol-1-yl)-4-methyl-1H-pyrazole-3-carboxamide | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H25Cl3N4O2 | ||
| Mol. Mass. | 531.861 | ||
| SMILES | COc1ccc(CCNC(=O)c2nn(c(c2C)-n2c(C)ccc2C)-c2ccc(Cl)cc2Cl)cc1Cl |(4.63,4.94,;6.17,5.08,;7.06,3.83,;8.59,3.97,;9.48,2.72,;8.84,1.32,;9.73,.06,;11.27,.21,;12.16,-1.05,;13.69,-.91,;14.33,.49,;14.58,-2.16,;14.08,-3.63,;15.33,-4.55,;16.58,-3.66,;16.12,-2.18,;17.04,-.95,;18.04,-4.15,;18.5,-5.61,;17.57,-6.85,;20.04,-5.63,;20.53,-4.17,;19.3,-3.25,;19.31,-1.72,;15.31,-6.08,;16.63,-6.87,;16.61,-8.41,;15.27,-9.16,;15.26,-10.7,;13.95,-8.38,;13.96,-6.84,;12.64,-6.06,;7.31,1.17,;6.41,2.43,;4.88,2.28,)| | ||
| Structure | 
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