Ki Summary

Reaction Details

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Target

Gonadotropin-releasing hormone receptor

Ligand

BDBM50104538

Substrate/Competitor

n/a

Meas. Tech.

ChEBML_71456

IC50

1±n/a nM

Citation

Ashton, WT; Sisco, RM; Kieczykowski, GR; Yang, YT; Yudkovitz, JB; Cui, J; Mount, GR; Ren, RN; Wu, TJ; Shen, X; Lyons, KA; Mao, AH; Carlin, JR; Karanam, BV; Vincent, SH; Cheng, K; Goulet, MT Orally bioavailable, indole-based nonpeptide GnRH receptor antagonists with high potency and functional activity. Bioorg Med Chem Lett11:2597-602 (2001) [PubMed]

More Info.:

Get all data from this article, Assay Method

Gonadotropin-releasing hormone receptor

Name:

Gonadotropin-releasing hormone receptor

Synonyms:

Type:

Enzyme

Mol. Mass.:

37749.45

Organism:

Homo sapiens (Human)

Description:

P30968

Residue:

328

Sequence:

MANSASPEQNQNHCSAINNSIPLMQGNLPTLTLSGKIRVTVTFFLFLLSATFNASFLLKL
QKWTQKKEKGKKLSRMKLLLKHLTLANLLETLIVMPLDGMWNITVQWYAGELLCKVLSYL
KLFSMYAPAFMMVVISLDRSLAITRPLALKSNSKVGQSMVGLAWILSSVFAGPQLYIFRM
IHLADSSGQTKVFSQCVTHCSFSQWWHQAFYNFFTFSCLFIIPLFIMLICNAKIIFTLTR
VLHQDPHELQLNQSKNNIPRARLKTLKMTVAFATSFTVCWTPYYVLGIWYWFDPEMLNRL
SDPVNHFFFLFAFLNPCFDPLIYGYFSL

BDBM50104538

n/a

Name

BDBM50104538

Synonyms:

1-(2-Aza-bicyclo[2.2.2]oct-2-yl)-2-{2-(3,5-dimethyl-phenyl)-3-[(S)-1-methyl-2-(4-pyridin-4-yl-butylamino)-ethyl]-1H-indol-5-yl}-2-methyl-propan-1-one | CHEMBL265288

Type

Small organic molecule

Emp. Form.

C39H50N4O

Mol. Mass.

590.8405

SMILES

C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1CC2CCC1CC2)-c1cc(C)cc(C)c1 |wD:1.0,THB:26:28:32.31:34.35,(5.75,.3,;6.52,-1.03,;8.06,-1.05,;8.83,.28,;10.37,.27,;11.14,1.6,;12.68,1.6,;13.46,2.93,;15,2.92,;15.78,4.25,;17.32,4.25,;18.09,2.92,;17.31,1.58,;15.76,1.58,;5.74,-2.36,;6.35,-3.78,;5.21,-4.79,;3.88,-4.02,;2.43,-4.49,;1.29,-3.46,;1.62,-1.96,;3.08,-1.49,;4.21,-2.53,;.47,-.92,;1.97,-.51,;-.62,.18,;-1,-1.38,;-1.32,-2.89,;-2.22,-.45,;-1.82,1.04,;-3.33,1.45,;-3.33,2.99,;-4.15,2.22,;-4.15,,;-5.2,-.45,;-4.81,1.04,;7.85,-4.11,;8.31,-5.58,;9.83,-5.9,;10.3,-7.36,;10.86,-4.76,;10.39,-3.29,;11.42,-2.15,;8.89,-2.96,)|

Structure