Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50571386

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2114591 (CHEMBL4823532)

EC50

237±n/a nM

Citation

Narayanan, S; Wang, S; Vasukuttan, V; Vyas Devambatla, RK; Dai, D; Jin, C; Snyder, R; Laudermilk, L; Runyon, SP; Maitra, R Pyrazole Agonist of the Apelin Receptor Improves Symptoms of Metabolic Syndrome in Mice. J Med Chem64:3006-3025 (2021) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Apelin receptor

Name:

Apelin receptor

Synonyms:

Type:

Enzyme Catalytic Domain

Mol. Mass.:

42664.06

Organism:

Homo sapiens (Human)

Description:

P35414

Residue:

380

Sequence:

MEEGGDFDNYYGADNQSECEYTDWKSSGALIPAIYMLVFLLGTTGNGLVLWTVFRSSREK
RRSADIFIASLAVADLTFVVTLPLWATYTYRDYDWPFGTFFCKLSSYLIFVNMYASVFCL
TGLSFDRYLAIVRPVANARLRLRVSGAVATAVLWVLAALLAMPVMVLRTTGDLENTTKVQ
CYMDYSMVATVSSEWAWEVGLGVSSTTVGFVVPFTIMLTCYFFIAQTIAGHFRKERIEGL
RKRRRLLSIIVVLVVTFALCWMPYHLVKTLYMLGSLLHWPCDFDLFLMNIFPYCTCISYV
NSCLNPFLYAFFDPRFRQACTSMLCCGQSRCAGTSHSSSGEKSASYSSGHSQGPGPNMGK
GGEQMHEKSIPYSQETLVVD

BDBM50571386

n/a

Name

BDBM50571386

Synonyms:

CHEMBL4863277

Type

Small organic molecule

Emp. Form.

C30H44ClN5O5

Mol. Mass.

590.154

SMILES

Cl.COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCOCC1)CC(=O)NC1CCC1 |r,wU:24.26,(81.45,-37.46,;71.97,-34.84,;73.11,-35.87,;72.79,-37.37,;71.33,-37.85,;71.01,-39.36,;72.17,-40.39,;73.63,-39.91,;74.77,-40.93,;74.46,-42.44,;73.94,-38.4,;75.39,-37.93,;75.87,-36.46,;77.41,-36.46,;77.89,-37.92,;76.64,-38.83,;76.65,-40.37,;75.41,-41.27,;75.88,-42.74,;77.42,-42.74,;77.9,-41.27,;78.31,-35.21,;77.68,-33.81,;79.84,-35.37,;80.75,-34.12,;80.12,-32.72,;81.02,-31.47,;80.39,-30.06,;81.31,-28.81,;80.68,-27.41,;79.15,-27.25,;78.24,-28.49,;78.87,-29.91,;82.28,-34.28,;83.18,-33.03,;82.55,-31.63,;84.71,-33.19,;85.62,-31.95,;87.13,-31.7,;86.89,-30.18,;85.37,-30.43,)|

Structure