Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50544740

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1993671 (CHEMBL4627566)

EC50

>10000±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

BDBM50544740

n/a

Name

BDBM50544740

Synonyms:

CHEMBL4637028

Type

Small organic molecule

Emp. Form.

C27H33N3O5

Mol. Mass.

479.568

SMILES

COc1cccc(OC)c1-c1cc(nn1CC(C)C)C(=O)N[C@@H](CCc1ccccc1)CC(O)=O |r,wU:22.24,(6.83,-26.11,;7.46,-27.52,;6.55,-28.76,;5.03,-28.6,;4.11,-29.85,;4.74,-31.26,;6.27,-31.42,;6.9,-32.83,;5.99,-34.08,;7.18,-30.17,;8.72,-30.32,;9.75,-29.18,;11.15,-29.8,;10.99,-31.33,;9.49,-31.66,;8.87,-33.06,;9.78,-34.3,;9.16,-35.71,;11.31,-34.13,;12.49,-29.03,;12.48,-27.49,;13.82,-29.8,;15.15,-29.02,;15.15,-27.48,;16.48,-26.71,;16.48,-25.17,;17.81,-24.4,;17.81,-22.87,;16.48,-22.1,;15.15,-22.87,;15.14,-24.41,;16.49,-29.79,;17.82,-29.02,;19.16,-29.79,;17.82,-27.48,)|

Structure