Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50571380

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2114593 (CHEMBL4823534)

EC50

>10000±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

BDBM50571380

n/a

Name

BDBM50571380

Synonyms:

CHEMBL4875648

Type

Small organic molecule

Emp. Form.

C26H38ClN5O5

Mol. Mass.

536.063

SMILES

Cl.COc1cccc(OC)c1-c1cc(nn1C1CCCC1)C(=O)N[C@@H](CCN1CCNCC1)CC(O)=O |r,wU:24.26,(81.56,-18.04,;71.57,-15.98,;72.72,-17.01,;72.4,-18.51,;70.94,-18.99,;70.62,-20.5,;71.77,-21.53,;73.23,-21.04,;74.38,-22.07,;74.07,-23.58,;73.55,-19.54,;75,-19.07,;75.47,-17.6,;77.01,-17.6,;77.49,-19.06,;76.25,-19.97,;76.26,-21.51,;75.01,-22.41,;75.49,-23.88,;77.03,-23.88,;77.5,-22.41,;77.92,-16.35,;77.29,-14.95,;79.45,-16.51,;80.35,-15.26,;79.72,-13.86,;80.63,-12.61,;80,-11.2,;80.91,-9.95,;80.29,-8.55,;78.76,-8.39,;77.85,-9.63,;78.47,-11.05,;81.89,-15.42,;82.79,-14.17,;84.32,-14.33,;82.16,-12.77,)|

Structure