Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50544743

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1993673 (CHEMBL4627568)

EC50

1460±n/a nM

Citation

Narayanan, S; Vasukuttan, V; Rajagopal, S; Maitra, R; Runyon, SP Identification of potent pyrazole based APELIN receptor (APJ) agonists. Bioorg Med Chem28:0 (2020) [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

BDBM50544743

n/a

Name

BDBM50544743

Synonyms:

CHEMBL4647813

Type

Small organic molecule

Emp. Form.

C24H33N3O5

Mol. Mass.

443.5359

SMILES

COc1cccc(OC)c1-c1cc(nn1C)C(=O)N[C@@H](CCC1CCCCC1)CC(O)=O |r,wU:19.21,(40.39,-35.41,;41.02,-36.82,;40.12,-38.07,;38.59,-37.91,;37.68,-39.15,;38.3,-40.56,;39.83,-40.73,;40.46,-42.13,;39.55,-43.38,;40.74,-39.47,;42.28,-39.62,;43.31,-38.48,;44.71,-39.1,;44.56,-40.63,;43.05,-40.96,;42.43,-42.36,;46.05,-38.33,;46.04,-36.79,;47.38,-39.1,;48.71,-38.33,;48.71,-36.79,;50.04,-36.01,;50.04,-34.47,;51.37,-33.71,;51.37,-32.17,;50.04,-31.4,;48.71,-32.17,;48.7,-33.71,;50.05,-39.09,;51.38,-38.32,;52.72,-39.09,;51.38,-36.78,)|

Structure