Ki Summary

Reaction Details

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Target

Prostaglandin D2 receptor 2

Ligand

BDBM50401099

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_884446 (CHEMBL2212208)

IC50

>1000±n/a nM

Citation

Kaila, N; Huang, A; Moretto, A; Follows, B; Janz, K; Lowe, M; Thomason, J; Mansour, TS; Hubeau, C; Page, K; Morgan, P; Fish, S; Xu, X; Williams, C; Saiah, E Diazine indole acetic acids as potent, selective, and orally bioavailable antagonists of chemoattractant receptor homologous molecule expressed on Th2 cells (CRTH2) for the treatment of allergic inflammatory diseases. J Med Chem55:5088-109 (2012) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Prostaglandin D2 receptor 2

Name:

Prostaglandin D2 receptor 2

Synonyms:

Type:

Enzyme

Mol. Mass.:

43295.45

Organism:

Homo sapiens (Human)

Description:

Q9Y5Y4

Residue:

395

Sequence:

MSANATLKPLCPILEQMSRLQSHSNTSIRYIDHAAVLLHGLASLLGLVENGVILFVVGCR
MRQTVVTTWVLHLALSDLLASASLPFFTYFLAVGHSWELGTTFCKLHSSIFFLNMFASGF
LLSAISLDRCLQVVRPVWAQNHRTVAAAHKVCLVLWALAVLNTVPYFVFRDTISRLDGRI
MCYYNVLLLNPGPDRDATCNSRQVALAVSKFLLAFLVPLAIIASSHAAVSLRLQHRGRRR
PGRFVRLVAAVVAAFALCWGPYHVFSLLEARAHANPGLRPLVWRGLPFVTSLAFFNSVAN
PVLYVLTCPDMLRKLRRSLRTVLESVLVDDSELGGAGSSRRRRTSSTARSASPLALCSRP
EEPRGPARLLGWLLGSCAASPQTGPLNRALSSTSS

BDBM50401099

n/a

Name

BDBM50401099

Synonyms:

CHEMBL2205157

Type

Small organic molecule

Emp. Form.

C27H23N3O3

Mol. Mass.

437.4898

SMILES

CC(C(O)=O)n1c(C)c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc12 |(8.1,-55.32,;6.59,-55,;5.56,-56.14,;4.05,-55.83,;6.04,-57.61,;6.11,-53.53,;7.02,-52.28,;8.56,-52.28,;6.11,-51.02,;6.89,-49.7,;8.43,-49.71,;9.2,-48.38,;10.74,-48.38,;11.51,-49.72,;10.73,-51.04,;11.49,-52.38,;13.03,-52.39,;13.81,-51.05,;13.04,-49.72,;8.44,-47.04,;9.21,-45.71,;6.9,-47.03,;6.12,-45.7,;4.57,-45.7,;3.8,-47.05,;4.58,-48.38,;6.12,-48.37,;4.64,-51.5,;3.3,-50.74,;1.97,-51.51,;1.97,-53.05,;3.3,-53.82,;4.64,-53.05,)|

Structure