Reaction Details | |||
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Target | Cannabinoid receptor 1 | ||
Ligand | BDBM50029974 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1438383 (CHEMBL3383058) | ||
Ki | 472±n/a nM | ||
Citation | Lucchesi, V; Hurst, DP; Shore, DM; Bertini, S; Ehrmann, BM; Allarà, M; Lawrence, L; Ligresti, A; Minutolo, F; Saccomanni, G; Sharir, H; Macchia, M; Di Marzo, V; Abood, ME; Reggio, PH; Manera, C CB2-selective cannabinoid receptor ligands: synthesis, pharmacological evaluation, and molecular modeling investigation of 1,8-Naphthyridin-2(1H)-one-3-carboxamides. J Med Chem57:8777-91 (2014) [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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BDBM50029974 | |||
n/a | |||
Name | BDBM50029974 | ||
Synonyms: | CHEMBL3353446 | ||
Type | Small organic molecule | ||
Emp. Form. | C27H26FN3O2S | ||
Mol. Mass. | 475.578 | ||
SMILES | C[C@H]1CC[C@H](CC1)NC(=O)c1cc2cc(cnc2n(Cc2ccc(F)cc2)c1=O)-c1cccs1 |r,wD:4.7,1.0,(18.83,-4.26,;17.5,-5.03,;16.16,-4.27,;14.82,-5.04,;14.83,-6.57,;16.18,-7.35,;17.5,-6.57,;13.51,-7.35,;12.17,-6.59,;12.16,-5.05,;10.84,-7.37,;9.5,-6.61,;8.18,-7.38,;6.84,-6.62,;5.51,-7.39,;5.51,-8.93,;6.84,-9.7,;8.18,-8.93,;9.51,-9.69,;9.52,-11.23,;10.85,-12,;10.85,-13.54,;12.18,-14.3,;13.52,-13.53,;14.85,-14.29,;13.51,-11.98,;12.17,-11.22,;10.85,-8.92,;12.18,-9.68,;4.17,-6.62,;2.76,-7.25,;1.73,-6.1,;2.5,-4.76,;4.01,-5.08,)| | ||
Structure |