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GPCR

NameGalanin receptor type 1
SpeciesHomo sapiens (Human)
GeneGALR1
SynonymGAL1-R
GALNR
GALNR1
GALR-1
GAL1 receptor
DiseaseEpileptic seizures
Length349
Amino acid sequenceMELAVGNLSEGNASWPEPPAPEPGPLFGIGVENFVTLVVFGLIFALGVLGNSLVITVLARSKPGKPRSTTNLFILNLSIADLAYLLFCIPFQATVYALPTWVLGAFICKFIHYFFTVSMLVSIFTLAAMSVDRYVAIVHSRRSSSLRVSRNALLGVGCIWALSIAMASPVAYHQGLFHPRASNQTFCWEQWPDPRHKKAYVVCTFVFGYLLPLLLICFCYAKVLNHLHKKLKNMSKKSEASKKKTAQTVLVVVVVFGISWLPHHIIHLWAEFGVFPLTPASFLFRITAHCLAYSNSSVNPIIYAFLSENFRKAYKQVFKCHIRKDSHLSDTKESKSRIDTPPSTNCTHV
UniProtP47211
Protein Data BankN/A
GPCR-HGmod modelP47211
3D structure modelThis predicted structure model is from GPCR-EXP P47211.
BioLiPN/A
Therapeutic Target DatabaseT78581
ChEMBLCHEMBL4894
IUPHAR243
DrugBankN/A

Ligand

NameCHEMBL1921997
Molecular formulaC24H26F3N5O2
IUPAC name2-N-cyclohexyl-6-N-(4-methoxyphenyl)-4-N-[4-(trifluoromethoxy)phenyl]pyrimidine-2,4,6-triamine
Molecular weight473.5
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP7.2
SynonymsBDBM50358656
SCHEMBL10144389
Inchi KeyJGQRXQSWNBCFIU-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H26F3N5O2/c1-33-19-11-7-17(8-12-19)28-21-15-22(32-23(31-21)30-16-5-3-2-4-6-16)29-18-9-13-20(14-10-18)34-24(25,26)27/h7-16H,2-6H2,1H3,(H3,28,29,30,31,32)
PubChem CID57392517
ChEMBLCHEMBL1921997
IUPHARN/A
BindingDB50358656
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
IC505930.0 nMPMID22018787BindingDB,ChEMBL
Inhibition60.0 %PMID22018787ChEMBL

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