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GPCR

NameProstaglandin D2 receptor 2
SpeciesHomo sapiens (Human)
GenePTGDR2
SynonymCD294
prostaglandin D2 receptor 2
PGD2 receptor
Gpr44
G-protein coupled receptor 44
[ Show all ]
DiseaseAsthma; Chronic obstructive pulmonary disease
Asthma
Allergy
Allergic rhinitis
Allergic asthma
[ Show all ]
Length395
Amino acid sequenceMSANATLKPLCPILEQMSRLQSHSNTSIRYIDHAAVLLHGLASLLGLVENGVILFVVGCRMRQTVVTTWVLHLALSDLLASASLPFFTYFLAVGHSWELGTTFCKLHSSIFFLNMFASGFLLSAISLDRCLQVVRPVWAQNHRTVAAAHKVCLVLWALAVLNTVPYFVFRDTISRLDGRIMCYYNVLLLNPGPDRDATCNSRQVALAVSKFLLAFLVPLAIIASSHAAVSLRLQHRGRRRPGRFVRLVAAVVAAFALCWGPYHVFSLLEARAHANPGLRPLVWRGLPFVTSLAFFNSVANPVLYVLTCPDMLRKLRRSLRTVLESVLVDDSELGGAGSSRRRRTSSTARSASPLALCSRPEEPRGPARLLGWLLGSCAASPQTGPLNRALSSTSS
UniProtQ9Y5Y4
Protein Data Bank6d27, 6d26
GPCR-HGmod modelQ9Y5Y4
3D structure modelThis structure is from PDB ID 6d27.
BioLiPBL0428440, BL0428439
Therapeutic Target DatabaseT61722
ChEMBLCHEMBL5071
IUPHAR339
DrugBankBE0003561

Ligand

NameSCHEMBL2444000
Molecular formulaC26H21ClN4O2S
IUPAC name2-chloro-N-[3-[4-[(2-methylindol-1-yl)methyl]phenyl]pyrazin-2-yl]benzenesulfonamide
Molecular weight488.99
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.0
SynonymsUS8796280, 43
ARTDRSOXFXPENH-UHFFFAOYSA-N
CHEMBL3694765
BDBM128353
2-Chloro-N-{3-[4-(2-methyl-indol-1-ylmethyl)-phenyl]-pyrazin-2-yl}-benzenesulfonamide
Inchi KeyARTDRSOXFXPENH-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H21ClN4O2S/c1-18-16-21-6-2-4-8-23(21)31(18)17-19-10-12-20(13-11-19)25-26(29-15-14-28-25)30-34(32,33)24-9-5-3-7-22(24)27/h2-16H,17H2,1H3,(H,29,30)
PubChem CID57586067
ChEMBLCHEMBL3694765
IUPHARN/A
BindingDB128353
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
Ki4110.0 nM, NoneBindingDB,ChEMBL

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