Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50570424

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2112154 (CHEMBL4821004)

EC50

1.4±n/a nM

Citation

Johnson, JA; Kim, SH; Jiang, J; Phillips, M; Schumacher, WA; Bostwick, JS; Gargalovic, PS; Onorato, JM; Luk, CE; Generaux, C; He, Y; Chen, XQ; Xu, C; Galella, MA; Wang, T; Gordon, DA; Wexler, RR; Finlay, HJ Discovery of a Hydroxypyridinone APJ Receptor Agonist as a Clinical Candidate. J Med Chem64:3086-3099 (2021) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Apelin receptor

Name:

Apelin receptor

Synonyms:

Type:

PROTEIN

Mol. Mass.:

42351.61

Organism:

Rattus norvegicus

Description:

ChEMBL_10710

Residue:

377

Sequence:

MEDDGYNYYGADNQSECDYADWTPSGALIPAIYILVFLLGTTGNGLVLWTVFWSSREKRR
SADIFIASLAVADLTFVVTLPLWATYTYREFDWPFGTFSCKLSSYLIFVNMYASVFCLTG
LSFDRYLAIVRPVANARLRLRVSGAVATAVLWVLAALLAVPVMVFRSTDIPENSTKTQCY
MDYSMVATSNSEWAWEVGLGVSSTAVGFVVPFIIMLTCYFFIAQTIAGHFRKERIEGLRK
RRRLLSIIVVLVVTFALCWMPYHLVKTLYMLGNLLHWPCDFDSFLMNVFPYCTCISYVNS
CLNPFLYAFFDPRFRRACTSMLCCDQSGCKGSPHSSSAEKSASYSSGHSQGPGPNMCKGG
EPMHEKSIPYSQETLVD

BDBM50570424

n/a

Name

BDBM50570424

Synonyms:

CHEMBL4860991

Type

Small organic molecule

Emp. Form.

C25H24ClN3O6

Mol. Mass.

497.928

SMILES

COCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(32.64,-24.82,;33.98,-25.59,;35.31,-24.81,;36.65,-25.57,;37.98,-24.79,;37.97,-23.26,;39.3,-22.48,;39.3,-20.94,;40.64,-23.24,;41.97,-22.47,;42.12,-20.94,;43.63,-20.61,;44.4,-21.94,;45.94,-22.1,;46.56,-23.51,;45.66,-24.75,;46.29,-26.15,;47.82,-26.31,;48.45,-27.72,;48.72,-25.05,;48.09,-23.66,;43.38,-23.09,;40.64,-24.78,;41.97,-25.55,;39.31,-25.55,;39.32,-27.09,;37.99,-27.86,;36.66,-27.09,;35.33,-27.87,;37.99,-29.4,;39.32,-30.17,;40.66,-29.4,;40.65,-27.85,;41.99,-27.08,;43.32,-27.85,)|

Structure