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GPCR

NameSphingosine 1-phosphate receptor 2
SpeciesRattus norvegicus (Rat)
GeneS1pr2
SynonymS1P2 receptor
S1P2
S1P receptor Edg-5
S1P receptor 2
GPCR18
[ Show all ]
DiseaseN/A for non-human GPCRs
Length352
Amino acid sequenceMGGLYSEYLNPEKVQEHYNYTKETLDMQETPSRKVASAFIIILCCAIVVENLLVLIAVARNSKFHSAMYLFLGNLAASDLLAGVAFVANTLLSGPVTLSLTPLQWFAREGSAFITLSASVFSLLAIAIERQVAIAKVKLYGSDKSCRMLMLIGASWLISLILGGLPILGWNCLDHLEACSTVLPLYAKHYVLCVVTIFSVILLAIVALYVRIYFVVRSSHADVAGPQTLALLKTVTIVLGVFIICWLPAFSILLLDSTCPVRACPVLYKAHYFFAFATLNSLLNPVIYTWRSRDLRREVLRPLLCWRQGKGATGRRGGNPGHRLLPLRSSSSLERGLHMPTSPTFLEGNTVV
UniProtP47752
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3616360
IUPHAR276
DrugBankN/A

Ligand

NameCHEMBL3703198
Molecular formulaC34H39FN2O6
IUPAC name1-[4-[3-[[4-(2-ethylbutyl)-4-hydroxypiperidine-1-carbonyl]amino]-5-(4-fluorophenoxy)phenoxy]phenyl]cyclopropane-1-carboxylic acid
Molecular weight590.692
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP6.5
SynonymsBDBM149706
SCHEMBL14839321
US8975409, Example 13
Inchi KeyUZPSRIVFHKJDOL-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H39FN2O6/c1-3-23(4-2)22-33(41)15-17-37(18-16-33)32(40)36-26-19-29(21-30(20-26)43-28-11-7-25(35)8-12-28)42-27-9-5-24(6-10-27)34(13-14-34)31(38)39/h5-12,19-21,23,41H,3-4,13-18,22H2,1-2H3,(H,36,40)(H,38,39)
PubChem CID89484778
ChEMBLCHEMBL3703198
IUPHARN/A
BindingDB149706
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
IC503.0 nM, NoneBindingDB,ChEMBL

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