Ki Summary

Reaction Details

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Target

Prostaglandin D2 receptor 2

Ligand

BDBM50401104

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

BDBM50401104

n/a

Name

BDBM50401104

Synonyms:

CHEMBL2205152

Type

Small organic molecule

Emp. Form.

C28H26N4O2

Mol. Mass.

450.5316

SMILES

CN(C)C(=O)Cn1c(C)c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc12 |(15.98,-25.02,;16.46,-26.48,;15.43,-27.63,;17.97,-26.8,;18.44,-28.27,;19,-25.65,;18.52,-24.19,;19.43,-22.93,;20.97,-22.93,;18.52,-21.68,;19.29,-20.35,;20.83,-20.36,;21.61,-19.03,;23.15,-19.04,;23.91,-20.38,;23.13,-21.7,;23.89,-23.03,;25.43,-23.04,;26.21,-21.7,;25.44,-20.37,;20.84,-17.7,;21.62,-16.37,;19.3,-17.69,;18.53,-16.35,;16.98,-16.36,;16.21,-17.71,;16.99,-19.04,;18.53,-19.03,;17.04,-22.16,;15.71,-21.4,;14.38,-22.17,;14.38,-23.71,;15.71,-24.48,;17.04,-23.71,)|

Structure