Ki Summary

Reaction Details

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Target

Sphingosine 1-phosphate receptor 5

Ligand

BDBM50559626

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2069852 (CHEMBL4725105)

EC50

267±n/a nM

Citation

Ma, B; Guckian, KM; Liu, XG; Yang, C; Li, B; Scannevin, R; Mingueneau, M; Drouillard, A; Walzer, T Novel Potent Selective Orally Active S1P5 Receptor Antagonists. ACS Med Chem Lett12:351-355 (2021) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Sphingosine 1-phosphate receptor 5

Name:

Sphingosine 1-phosphate receptor 5

Synonyms:

EDG8 | Endothelial differentiation sphingolipid G-protein-coupled receptor 8 | S1P5 | S1PR5 | S1PR5_HUMAN | Sphingosine 1-phosphate receptor | Sphingosine 1-phosphate receptor Edg-8

Type:

G Protein-Coupled Receptor (GPCR)

Mol. Mass.:

41796.42

Organism:

Homo sapiens (Human)

Description:

n/a

Residue:

398

Sequence:

MESGLLRPAPVSEVIVLHYNYTGKLRGARYQPGAGLRADAVVCLAVCAFIVLENLAVLLV
LGRHPRFHAPMFLLLGSLTLSDLLAGAAYAANILLSGPLTLKLSPALWFAREGGVFVALT
ASVLSLLAIALERSLTMARRGPAPVSSRGRTLAMAAAAWGVSLLLGLLPALGWNCLGRLD
ACSTVLPLYAKAYVLFCVLAFVGILAAICALYARIYCQVRANARRLPARPGTAGTTSTRA
RRKPRSLALLRTLSVVLLAFVACWGPLFLLLLLDVACPARTCPVLLQADPFLGLAMANSL
LNPIIYTLTNRDLRHALLRLVCCGRHSCGRDPSGSQQSASAAEASGGLRRCLPPGLDGSF
SGSERSSPQRDGLDTSGSTGSPGAPTAARTLVSEPAAD

BDBM50559626

n/a

Name

BDBM50559626

Synonyms:

CHEMBL4798888

Type

Small organic molecule

Emp. Form.

C24H33NO3

Mol. Mass.

383.5237

SMILES

Cc1cc(O[C@H]2CC[C@@H](CC2)C(C)(C)C)c(CNCC(O)=O)c2ccccc12 |r,wU:8.11,wD:5.4,(14.63,-4.87,;14.63,-6.41,;13.3,-7.18,;13.3,-8.72,;11.97,-9.49,;10.63,-8.72,;10.64,-7.17,;9.32,-6.4,;7.98,-7.16,;7.97,-8.71,;9.31,-9.49,;6.65,-6.39,;6.66,-4.85,;5.31,-7.15,;5.3,-5.62,;14.64,-9.49,;14.64,-11.03,;15.98,-11.8,;15.98,-13.34,;17.31,-14.11,;17.32,-15.65,;18.65,-13.33,;15.97,-8.71,;17.3,-9.48,;18.64,-8.71,;18.63,-7.16,;17.29,-6.4,;15.97,-7.17,)|

Structure