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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cannabinoid receptor 1 | ||
| Ligand | BDBM50169952 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_564384 (CHEMBL962379) | ||
| Ki | 48.6±n/a nM | ||
| Citation |  Ferreira, AM; Krishnamurthy, M; Moore, BM; Finkelstein, D; Bashford, D Quantitative structure-activity relationship (QSAR) for a series of novel cannabinoid derivatives using descriptors derived from semi-empirical quantum-chemical calculations. Bioorg Med Chem17:2598-606 (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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| BDBM50169952 | |||
| n/a | |||
| Name | BDBM50169952 | ||
| Synonyms: | (6aR,10aR)-3-Adamantan-2-ylidenemethyl-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol | AM-755 | CHEMBL191324 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H34O2 | ||
| Mol. Mass. | 390.5577 | ||
| SMILES | CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C=C3C4CC5CC(C4)CC3C5)cc1OC2(C)C |r,wU:5.7,wD:4.3,t:1,TLB:12:13:15:19.17.18,THB:17:16:13:19.18.20,17:18:15.16.22:13,20:18:15:22.21.13,20:21:15:19.17.18,(22.24,-4.11,;22.24,-5.66,;20.9,-6.44,;20.9,-7.98,;22.24,-8.75,;23.57,-7.98,;23.57,-6.44,;24.9,-8.75,;26.23,-7.99,;26.24,-6.45,;27.55,-8.76,;27.55,-10.31,;28.88,-11.09,;30.23,-10.32,;30.23,-8.83,;29.03,-7.55,;30.54,-7.97,;31.95,-7.4,;32.97,-8.69,;31.57,-8.34,;32.98,-10.22,;31.58,-10.8,;30.53,-9.56,;26.21,-11.06,;24.89,-10.29,;23.56,-11.06,;22.23,-10.28,;20.73,-10.68,;21.82,-11.77,)| | ||
| Structure | 
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