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GPCR

NameProbable G-protein coupled receptor 174
SpeciesHomo sapiens (Human)
GeneGPR174
SynonymFKSG79
GPR174
DiseaseN/A
Length333
Amino acid sequenceMPANYTCTRPDGDNTDFRYFIYAVTYTVILVPGLIGNILALWVFYGYMKETKRAVIFMINLAIADLLQVLSLPLRIFYYLNHDWPFGPGLCMFCFYLKYVNMYASIYFLVCISVRRFWFLMYPFRFHDCKQKYDLYISIAGWLIICLACVLFPLLRTSDDTSGNRTKCFVDLPTRNVNLAQSVVMMTIGELIGFVTPLLIVLYCTWKTVLSLQDKYPMAQDLGEKQKALKMILTCAGVFLICFAPYHFSFPLDFLVKSNEIKSCLARRVILIFHSVALCLASLNSCLDPVIYYFSTNEFRRRLSRQDLHDSIQLHAKSFVSNHTASTMTPELC
UniProtQ9BXC1
Protein Data BankN/A
GPCR-HGmod modelQ9BXC1
3D structure modelThis predicted structure model is from GPCR-EXP Q9BXC1.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3562167
IUPHAR145
DrugBankN/A

Ligand

NameCHEMBL3577162
Molecular formulaC25H48NO9P
IUPAC name(2S,3S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-[(Z)-octadec-9-enoyl]oxypropoxy]phosphoryl]oxybutanoic acid
Molecular weight537.631
Hydrogen bond acceptor10
Hydrogen bond donor4
XlogP2.6
SynonymsBDBM50096584
(2S,3S)-2-Amino-3-[[1-O-[(9Z)-9-octadecenoyl]-L-glycero-3-phospho]oxy]butanoic acid
Inchi KeyTUOGAVKNETYDTH-IKZNXBAASA-N
Inchi IDInChI=1S/C25H48NO9P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(28)33-19-22(27)20-34-36(31,32)35-21(2)24(26)25(29)30/h10-11,21-22,24,27H,3-9,12-20,26H2,1-2H3,(H,29,30)(H,31,32)/b11-10-/t21-,22+,24-/m0/s1
PubChem CID101780960
ChEMBLCHEMBL3577162
IUPHARN/A
BindingDB50096584
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
EC50830.0 nMPMID25970039BindingDB,ChEMBL
EC50831.76 nMPMID25970039ChEMBL
EC50832.0 nMPMID25970039BindingDB

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