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GPCR

NamePlatelet-activating factor receptor
SpeciesMus musculus (Mouse)
GenePtafr
SynonymAGEPC receptor
PAF receptor
PAF-R
PAFr
DiseaseN/A for non-human GPCRs
Length341
Amino acid sequenceMEHNGSFRVDSEFRYTLFPIVYSVIFILGVVANGYVLWVFANLYPSKKLNEIKIFMVNLTMADLLFLITLPLWIVYYYNEGDWILPNFLCNVAGCLFFINTYCSVAFLGVITYNRYQAVAYPIKTAQATTRKRGISLSLIIWVSIVATASYFLATDSTNLVPNKDGSGNITRCFEHYEPYSVPILVVHVFIAFCFFLVFFLIFYCNLVIIHTLLTQPMRQQRKAGVKRRALWMVCTVLAVFIICFVPHHVVQLPWTLAELGYQTNFHQAINDAHQITLCLLSTNCVLDPVIYCFLTKKFRKHLSEKFYSMRSSRKCSRATSDTCTEVIVPANQTPIVSLKN
UniProtQ62035
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3993
IUPHAR334
DrugBankN/A

Ligand

NameCHEMBL349150
Molecular formulaC40H41ClN6O2S
IUPAC nameethyl (E)-7-[4-[[9-(2-chlorophenyl)-3,7-dimethyl-17-thia-2,4,5,8,14-pentazatetracyclo[8.7.0.02,6.011,16]heptadeca-1(10),3,5,8,11(16)-pentaen-14-yl]methyl]phenyl]-7-pyridin-3-ylhept-6-enoate
Molecular weight705.318
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP7.9
SynonymsBDBM50110455
6-(2-Chlorophenyl)-3-[4-[(E/Z)-6-ethoxycarbonyl-1-(3-pyridyl)-1-hexenyl]phenylmethyl]-8,11-dimethyl-2,3,4,5-tetrahydro-8H-pyrido[4'',3'':4,5]-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
Inchi KeyGCTAXPRQXHZAPH-KLPHOBTLSA-N
Inchi IDInChI=1S/C40H41ClN6O2S/c1-4-49-36(48)15-7-5-6-12-31(30-11-10-21-42-23-30)29-18-16-28(17-19-29)24-46-22-20-33-35(25-46)50-40-37(33)38(32-13-8-9-14-34(32)41)43-26(2)39-45-44-27(3)47(39)40/h8-14,16-19,21,23,26H,4-7,15,20,22,24-25H2,1-3H3/b31-12+
PubChem CID44377843
ChEMBLCHEMBL349150
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
ED500.55 mg.kg-1PMID11858999ChEMBL
ED501.6 mg.kg-1PMID11858999ChEMBL

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