Reaction Details | |||
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Target | Corticotropin-releasing factor receptor 1 | ||
Ligand | BDBM50417505 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_685890 (CHEMBL1292646) | ||
Ki | 50.12±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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BDBM50417505 | |||
n/a | |||
Name | BDBM50417505 | ||
Synonyms: | CHEMBL1287965 | ||
Type | Small organic molecule | ||
Emp. Form. | C23H26N6O2 | ||
Mol. Mass. | 418.4915 | ||
SMILES | COc1ccc(-c2c(C)nn3c(NC4(CCC4)c4nc(C)no4)cc(C)nc23)c(C)c1 |(23.57,-41.97,;22.03,-41.99,;21.24,-40.66,;19.7,-40.67,;18.92,-39.37,;19.67,-38.02,;18.88,-36.7,;19.78,-35.46,;21.32,-35.45,;18.87,-34.21,;17.42,-34.69,;16.08,-33.93,;16.08,-32.38,;14.74,-31.62,;13.68,-30.52,;14.78,-29.45,;15.84,-30.55,;13.51,-32.56,;12.04,-32.11,;11.17,-33.36,;9.63,-33.4,;12.09,-34.59,;13.55,-34.1,;14.74,-34.7,;14.75,-36.24,;13.42,-37.02,;16.09,-37,;17.42,-36.23,;21.21,-38,;21.96,-36.65,;22,-39.33,)| | ||
Structure |