Ki Summary

Reaction Details

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Target

Apelin receptor

Ligand

BDBM50506020

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1824655 (CHEMBL4324419)

EC50

0.180000±n/a nM

Citation

Su, S; Clarke, A; Han, Y; Chao, HJ; Bostwick, J; Schumacher, W; Wang, T; Yan, M; Hsu, MY; Simmons, E; Luk, C; Xu, C; Dabros, M; Galella, M; Onorato, J; Gordon, D; Wexler, R; Gargalovic, PS; Lawrence, RM Biphenyl Acid Derivatives as APJ Receptor Agonists. J Med Chem62:10456-10465 (2019) [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

BDBM50506020

n/a

Name

BDBM50506020

Synonyms:

CHEMBL4450702

Type

Small organic molecule

Emp. Form.

C32H29N3O3

Mol. Mass.

503.591

SMILES

CCC[C@@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1c(C)cccc1-c1nc2ccccc2[nH]1)c1ccccc1 |r,wD:3.35,(52.74,-6.81,;54.08,-6.04,;55.41,-6.81,;56.75,-6.04,;58.09,-6.8,;59.42,-6.03,;59.42,-4.49,;60.76,-6.8,;60.76,-8.35,;62.09,-9.11,;63.42,-8.34,;63.42,-6.8,;62.09,-6.03,;64.76,-6.03,;64.76,-4.49,;66.09,-6.8,;64.75,-9.11,;66.08,-8.34,;66.84,-6.99,;67.42,-9.11,;67.42,-10.66,;66.08,-11.43,;64.75,-10.66,;63.41,-11.43,;62.01,-10.81,;60.99,-11.95,;59.45,-11.95,;58.67,-13.27,;59.45,-14.61,;60.98,-14.61,;61.75,-13.28,;63.26,-12.96,;56.75,-4.5,;58.08,-3.73,;58.08,-2.19,;56.74,-1.42,;55.4,-2.2,;55.41,-3.74,)|

Structure