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GPCR

NamePlatelet-activating factor receptor
SpeciesHomo sapiens (Human)
GenePTAFR
SynonymPAF receptor
AGEPC receptor
PAF-R
PAFr
DiseaseUnspecified
Thrombocytopenia
Stroke
Solid tumours
Septic shock
[ Show all ]
Length342
Amino acid sequenceMEPHDSSHMDSEFRYTLFPIVYSIIFVLGVIANGYVLWVFARLYPCKKFNEIKIFMVNLTMADMLFLITLPLWIVYYQNQGNWILPKFLCNVAGCLFFINTYCSVAFLGVITYNRFQAVTRPIKTAQANTRKRGISLSLVIWVAIVGAASYFLILDSTNTVPDSAGSGNVTRCFEHYEKGSVPVLIIHIFIVFSFFLVFLIILFCNLVIIRTLLMQPVQQQRNAEVKRRALWMVCTVLAVFIICFVPHHVVQLPWTLAELGFQDSKFHQAINDAHQVTLCLLSTNCVLDPVIYCFLTKKFRKHLTEKFYSMRSSRKCSRATTDTVTEVVVPFNQIPGNSLKN
UniProtP25105
Protein Data Bank5zkp, 5zkq
GPCR-HGmod modelP25105
3D structure modelThis structure is from PDB ID 5zkp.
BioLiPBL0417416,BL0417418, BL0417414, BL0417415, BL0417417,BL0417419
Therapeutic Target DatabaseT87023
ChEMBLCHEMBL250
IUPHAR334
DrugBankBE0005561

Ligand

NameCHEMBL2304197
Molecular formulaC17H20Cl2O6
IUPAC name(1S,3R,6R,7S,8S,10R,12R,13R)-8-tert-butyl-12,13-dichloro-6-hydroxy-2,4,16-trioxapentacyclo[8.4.2.01,11.03,7.07,11]hexadecane-5,15-dione
Molecular weight391.241
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.5
SynonymsN/A
Inchi KeyAHTCCGZPYMLWRO-GPUYIJSYSA-N
Inchi IDInChI=1S/C17H20Cl2O6/c1-14(2,3)7-4-8-17-9(19)6(18)5-15(17,12(22)23-8)25-13-16(7,17)10(20)11(21)24-13/h6-10,13,20H,4-5H2,1-3H3/t6-,7+,8-,9+,10+,13+,15-,16+,17?/m1/s1
PubChem CID71718506
ChEMBLCHEMBL2304197
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Binding affinity1.3 uMPMID9871752ChEMBL
Binding affinity5.89 uMPMID9871752ChEMBL

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