Reaction Details | |||
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Target | Corticotropin-releasing factor receptor 1 | ||
Ligand | BDBM50417506 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_685890 (CHEMBL1292646) | ||
Ki | 31.62±n/a nM | ||
Citation | Tellew, JE; Lanier, M; Moorjani, M; Lin, E; Luo, Z; Slee, DH; Zhang, X; Hoare, SR; Grigoriadis, DE; St Denis, Y; Di Fabio, R; Di Modugno, E; Saunders, J; Williams, JP Discovery of NBI-77860/GSK561679, a potent corticotropin-releasing factor (CRF1) receptor antagonist with improved pharmacokinetic properties. Bioorg Med Chem Lett20:7259-64 (2010) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Corticotropin-releasing factor receptor 1 | |||
Name: | Corticotropin-releasing factor receptor 1 | ||
Synonyms: | CRF-R | CRF-R2 Alpha | CRF1 | CRFR | CRFR1 | CRFR1_HUMAN | CRH-R 1 | CRHR | CRHR1 | Corticotropin releasing factor receptor 1 | Corticotropin-releasing factor receptor 1 (CRF-1) | Corticotropin-releasing factor receptor 1 (CRF1) | Corticotropin-releasing hormone receptor 1 | ||
Type: | Enzyme | ||
Mol. Mass.: | 50744.31 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P34998 | ||
Residue: | 444 | ||
Sequence: |
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BDBM50417506 | |||
n/a | |||
Name | BDBM50417506 | ||
Synonyms: | CHEMBL1287966 | ||
Type | Small organic molecule | ||
Emp. Form. | C22H26N6O2 | ||
Mol. Mass. | 406.4808 | ||
SMILES | COc1ccc(-c2c(C)nn3c(NC(C)Cc4nc(C)no4)cc(C)nc23)c(C)c1 |(23.42,-39.36,;21.87,-39.32,;21.13,-37.97,;19.59,-37.92,;18.86,-36.59,;19.65,-35.27,;18.91,-33.92,;19.83,-32.69,;21.37,-32.69,;18.93,-31.43,;17.46,-31.89,;16.13,-31.12,;16.14,-29.57,;14.82,-28.8,;14.83,-27.26,;13.49,-29.55,;12.28,-28.6,;10.8,-29.02,;9.95,-27.74,;8.42,-27.68,;10.9,-26.54,;12.34,-27.07,;14.78,-31.88,;14.78,-33.42,;13.44,-34.19,;16.11,-34.2,;17.45,-33.43,;21.19,-35.3,;21.99,-33.98,;21.94,-36.66,)| | ||
Structure |