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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

NameCHEMBL3577264
Molecular formulaC23H38NO10P
IUPAC name(2S,3S)-2-amino-3-[[(2R)-3-[3-(3-heptoxyphenyl)propanoyloxy]-2-hydroxypropoxy]-hydroxyphosphoryl]oxybutanoic acid
Molecular weight519.528
Hydrogen bond acceptor11
Hydrogen bond donor4
XlogP-0.2
SynonymsBDBM50096585
Inchi KeyITLYIRMTAPOHDS-KPLVRAHFSA-N
Inchi IDInChI=1S/C23H38NO10P/c1-3-4-5-6-7-13-31-20-10-8-9-18(14-20)11-12-21(26)32-15-19(25)16-33-35(29,30)34-17(2)22(24)23(27)28/h8-10,14,17,19,22,25H,3-7,11-13,15-16,24H2,1-2H3,(H,27,28)(H,29,30)/t17-,19+,22-/m0/s1
PubChem CID122177591
ChEMBLCHEMBL3577264
IUPHARN/A
BindingDB50096585
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
EC50720.0 nMPMID25970039BindingDB,ChEMBL
EC50724.0 nMPMID25970039BindingDB
EC50724.44 nMPMID25970039ChEMBL

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