Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50571378

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2114593 (CHEMBL4823534)

EC50

5574±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

BDBM50571378

n/a

Name

BDBM50571378

Synonyms:

CHEMBL4852570

Type

Small organic molecule

Emp. Form.

C27H39ClN4O5

Mol. Mass.

535.075

SMILES

Cl.COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCCCC1)CC(O)=O |r,wU:24.26,(57.58,-16.5,;46.68,-13.06,;47.83,-14.09,;47.51,-15.59,;46.05,-16.07,;45.73,-17.58,;46.88,-18.61,;48.34,-18.13,;49.49,-19.15,;49.18,-20.66,;48.65,-16.63,;50.11,-16.15,;50.58,-14.68,;52.12,-14.68,;52.6,-16.15,;51.36,-17.05,;51.36,-18.59,;50.12,-19.5,;50.59,-20.96,;52.13,-20.96,;52.61,-19.5,;53.03,-13.43,;52.4,-12.03,;54.56,-13.59,;55.46,-12.35,;54.83,-10.94,;55.74,-9.69,;55.11,-8.29,;56.02,-7.04,;55.4,-5.64,;53.87,-5.47,;52.96,-6.72,;53.58,-8.13,;56.99,-12.5,;57.9,-11.26,;59.43,-11.42,;57.27,-9.85,)|

Structure