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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cannabinoid receptor 1 | ||
| Ligand | BDBM50198537 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_437693 (CHEMBL905968) | ||
| IC50 | 16±n/a nM | ||
| Citation |  Smith, RA; Fathi, Z; Brown, SE; Choi, S; Fan, J; Jenkins, S; Kluender, HC; Konkar, A; Lavoie, R; Mays, R; Natoli, J; O'Connor, SJ; Ortiz, AA; Podlogar, B; Taing, C; Tomlinson, S; Tritto, T; Zhang, Z Constrained analogs of CB-1 antagonists: 1,5,6,7-Tetrahydro-4H-pyrrolo[3,2-c]pyridine-4-one derivatives. Bioorg Med Chem Lett17:673-8 (2007) [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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| BDBM50198537 | |||
| n/a | |||
| Name | BDBM50198537 | ||
| Synonyms: | 5-cyclohexyl-1-(2,4-dichlorophenyl)-3-methyl-2-phenyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one | CHEMBL230465 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C26H26Cl2N2O | ||
| Mol. Mass. | 453.403 | ||
| SMILES | Cc1c2c(CCN(C3CCCCC3)C2=O)n(c1-c1ccccc1)-c1ccc(Cl)cc1Cl |(-3.71,-25.55,;-3.22,-27.01,;-1.74,-27.47,;-1.74,-29.03,;-.4,-29.8,;.94,-29.03,;.94,-27.48,;2.27,-26.71,;3.61,-27.49,;4.94,-26.73,;4.95,-25.19,;3.61,-24.42,;2.27,-25.18,;-.4,-26.7,;-.4,-25.16,;-3.21,-29.51,;-4.12,-28.27,;-5.66,-28.28,;-6.44,-26.96,;-7.97,-26.97,;-8.73,-28.31,;-7.95,-29.64,;-6.41,-29.62,;-3.68,-30.98,;-5.18,-31.3,;-5.65,-32.76,;-4.61,-33.9,;-5.08,-35.37,;-3.1,-33.57,;-2.64,-32.1,;-1.14,-31.77,)| | ||
| Structure | 
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