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GPCR

NamePlatelet-activating factor receptor
SpeciesHomo sapiens (Human)
GenePTAFR
SynonymPAFr
PAF-R
PAF receptor
AGEPC receptor
DiseaseNerve injury
Ocular allergy
Pain
Unspecified
Psoriasis
[ Show all ]
Length342
Amino acid sequenceMEPHDSSHMDSEFRYTLFPIVYSIIFVLGVIANGYVLWVFARLYPCKKFNEIKIFMVNLTMADMLFLITLPLWIVYYQNQGNWILPKFLCNVAGCLFFINTYCSVAFLGVITYNRFQAVTRPIKTAQANTRKRGISLSLVIWVAIVGAASYFLILDSTNTVPDSAGSGNVTRCFEHYEKGSVPVLIIHIFIVFSFFLVFLIILFCNLVIIRTLLMQPVQQQRNAEVKRRALWMVCTVLAVFIICFVPHHVVQLPWTLAELGFQDSKFHQAINDAHQVTLCLLSTNCVLDPVIYCFLTKKFRKHLTEKFYSMRSSRKCSRATTDTVTEVVVPFNQIPGNSLKN
UniProtP25105
Protein Data Bank5zkq, 5zkp
GPCR-HGmod modelP25105
3D structure modelThis structure is from PDB ID 5zkq.
BioLiPBL0417415, BL0417417,BL0417419, BL0417416,BL0417418, BL0417414
Therapeutic Target DatabaseT87023
ChEMBLCHEMBL250
IUPHAR334
DrugBankBE0005561

Ligand

NameCHEMBL51798
Molecular formulaC31H39NO8S2
IUPAC name3-[2-[2-methoxy-6-propylsulfonyl-4-[(5S)-5-(3,4,5-trimethoxyphenyl)oxolan-2-yl]phenoxy]ethylsulfanyl]aniline
Molecular weight617.772
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP5.1
SynonymsN/A
Inchi KeyAFDDVYCYZWTCRW-SKCDSABHSA-N
Inchi IDInChI=1S/C31H39NO8S2/c1-6-14-42(33,34)29-18-21(17-28(37-4)31(29)39-12-13-41-23-9-7-8-22(32)19-23)25-11-10-24(40-25)20-15-26(35-2)30(38-5)27(16-20)36-3/h7-9,15-19,24-25H,6,10-14,32H2,1-5H3/t24-,25?/m0/s1
PubChem CID44297695
ChEMBLCHEMBL51798
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Inhibition80.0 %Bioorg. Med. Chem. Lett., (1992) 2:2:181ChEMBL

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