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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Gonadotropin-releasing hormone receptor | ||
| Ligand | BDBM50548467 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_2022368 (CHEMBL4676181) | ||
| IC50 | 26±n/a nM | ||
| Citation |  Panknin, O; Wagenfeld, A; Bone, W; Bender, E; Nowak-Reppel, K; Fernández-Montalván, AE; Nubbemeyer, R; Bäurle, S; Ring, S; Schmees, N; Prien, O; Schäfer, M; Friedrich, C; Zollner, TM; Steinmeyer, A; Mueller, T; Langer, G Discovery and Characterization of BAY 1214784, an Orally Available Spiroindoline Derivative Acting as a Potent and Selective Antagonist of the Human Gonadotropin-Releasing Hormone Receptor as Proven in a First-In-Human Study in Postmenopausal Women. J Med Chem63:11854-11881 (2020) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Gonadotropin-releasing hormone receptor | |||
| Name: | Gonadotropin-releasing hormone receptor | ||
| Synonyms: | GNRHR | GNRHR_HUMAN | GRHR | GnRH receptor | GnRH-R | Gonadotropin releasing hormone 1 (GnRHR1) | Gonadotropin-releasing hormone receptor | Gonadotropin-releasing hormone receptor (GnRH) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 37749.45 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P30968 | ||
| Residue: | 328 | ||
| Sequence: |
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| BDBM50548467 | |||
| n/a | |||
| Name | BDBM50548467 | ||
| Synonyms: | CHEMBL4787856 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C28H28FN3O4S | ||
| Mol. Mass. | 521.603 | ||
| SMILES | OC1CCC2(CC1)C(C1CC1)N(c1ccc(NC(=O)c3cccnc3)cc21)S(=O)(=O)c1ccc(F)cc1 |(36.16,-32.54,;35.77,-34.03,;36.86,-35.12,;36.47,-36.6,;34.98,-37.01,;33.89,-35.93,;34.29,-34.44,;35.91,-38.25,;37.45,-38.23,;38.8,-38.98,;38.77,-37.44,;35.02,-39.51,;33.54,-39.05,;32.2,-39.83,;30.86,-39.06,;30.86,-37.52,;29.53,-36.76,;28.2,-37.54,;28.2,-39.08,;26.86,-36.77,;26.86,-35.24,;25.52,-34.47,;24.19,-35.25,;24.2,-36.8,;25.54,-37.55,;32.18,-36.75,;33.52,-37.5,;35.51,-40.97,;36.99,-40.56,;36.6,-42.05,;34.49,-42.13,;32.98,-41.83,;31.97,-42.99,;32.47,-44.45,;31.46,-45.61,;33.99,-44.74,;35,-43.58,)| | ||
| Structure | 
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