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GPCR

NameLeukotriene B4 receptor 2
SpeciesHomo sapiens (Human)
GeneLTB4R2
SynonymNOP9
12-HHT receptor
Seven transmembrane receptor BLTR2
LTB4-R2
LTB4-R 2
[ Show all ]
DiseaseInflammatory bowel disease
Length358
Amino acid sequenceMSVCYRPPGNETLLSWKTSRATGTAFLLLAALLGLPGNGFVVWSLAGWRPARGRPLAATLVLHLALADGAVLLLTPLFVAFLTRQAWPLGQAGCKAVYYVCALSMYASVLLTGLLSLQRCLAVTRPFLAPRLRSPALARRLLLAVWLAALLLAVPAAVYRHLWRDRVCQLCHPSPVHAAAHLSLETLTAFVLPFGLMLGCYSVTLARLRGARWGSGRHGARVGRLVSAIVLAFGLLWAPYHAVNLLQAVAALAPPEGALAKLGGAGQAARAGTTALAFFSSSVNPVLYVFTAGDLLPRAGPRFLTRLFEGSGEARGGGRSREGTMELRTTPQLKVVGQGRGNGDPGGGMEKDGPEWDL
UniProtQ9NPC1
Protein Data BankN/A
GPCR-HGmod modelQ9NPC1
3D structure modelThis predicted structure model is from GPCR-EXP Q9NPC1.
BioLiPN/A
Therapeutic Target DatabaseT30563
ChEMBLCHEMBL3191
IUPHAR268
DrugBankBE0003489

Ligand

NameCHEMBL1099323
Molecular formulaC37H40O6
IUPAC name4-[2-(2-carboxyethyl)-3-[6-(3,5-diphenylphenoxy)hexyl]phenoxy]butanoic acid
Molecular weight580.721
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP8.5
SynonymsBDBM50317625
SCHEMBL1689881
4-{2-(2-Carboxyethyl)-3-[6-([1,1'',3,1'''']terphenyl-5''-yloxy)-hexyl]phenoxy}butyric Acid
Inchi KeySMNCEXHPBATBIT-UHFFFAOYSA-N
Inchi IDInChI=1S/C37H40O6/c38-36(39)20-12-24-43-35-19-11-18-30(34(35)21-22-37(40)41)17-5-1-2-10-23-42-33-26-31(28-13-6-3-7-14-28)25-32(27-33)29-15-8-4-9-16-29/h3-4,6-9,11,13-16,18-19,25-27H,1-2,5,10,12,17,20-24H2,(H,38,39)(H,40,41)
PubChem CID25192021
ChEMBLCHEMBL1099323
IUPHARN/A
BindingDB50317625
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
IC50628.0 nMPMID20380377BindingDB,ChEMBL

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