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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cannabinoid receptor 1 | ||
| Ligand | BDBM50198514 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_437693 (CHEMBL905968) | ||
| IC50 | 23±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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| BDBM50198514 | |||
| n/a | |||
| Name | BDBM50198514 | ||
| Synonyms: | 2-(benzo[b]thiophen-2-yl)-5-cyclohexyl-1-(2,4-dichlorophenyl)-3-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one | CHEMBL230890 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C28H26Cl2N2OS | ||
| Mol. Mass. | 509.49 | ||
| SMILES | Cc1c2c(CCN(C3CCCCC3)C2=O)n(c1-c1cc2ccccc2s1)-c1ccc(Cl)cc1Cl |(-.85,-21.19,;-.36,-22.65,;1.12,-23.12,;1.13,-24.67,;2.46,-25.44,;3.81,-24.67,;3.81,-23.13,;5.14,-22.36,;6.48,-23.14,;7.81,-22.38,;7.81,-20.84,;6.48,-20.06,;5.14,-20.83,;2.46,-22.35,;2.46,-20.81,;-.34,-25.16,;-1.26,-23.92,;-2.8,-23.93,;-3.68,-25.18,;-5.15,-24.72,;-6.47,-25.5,;-7.81,-24.74,;-7.82,-23.2,;-6.5,-22.42,;-5.16,-23.18,;-3.7,-22.69,;-.81,-26.63,;-2.32,-26.95,;-2.79,-28.41,;-1.75,-29.55,;-2.21,-31.02,;-.24,-29.22,;.22,-27.75,;1.73,-27.42,)| | ||
| Structure | 
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