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GPCR

NameProkineticin receptor 1
SpeciesHomo sapiens (Human)
GenePROKR1
SynonymVEGFR-1
PKR1
PK-R1
GPR73a
GPR73
[ Show all ]
DiseaseN/A
Length393
Amino acid sequenceMETTMGFMDDNATNTSTSFLSVLNPHGAHATSFPFNFSYSDYDMPLDEDEDVTNSRTFFAAKIVIGMALVGIMLVCGIGNFIFIAALVRYKKLRNLTNLLIANLAISDFLVAIVCCPFEMDYYVVRQLSWEHGHVLCTSVNYLRTVSLYVSTNALLAIAIDRYLAIVHPLRPRMKCQTATGLIALVWTVSILIAIPSAYFTTETVLVIVKSQEKIFCGQIWPVDQQLYYKSYFLFIFGIEFVGPVVTMTLCYARISRELWFKAVPGFQTEQIRKRLRCRRKTVLVLMCILTAYVLCWAPFYGFTIVRDFFPTVFVKEKHYLTAFYIVECIAMSNSMINTLCFVTVKNDTVKYFKKIMLLHWKASYNGGKSSADLDLKTIGMPATEEVDCIRLK
UniProtQ8TCW9
Protein Data BankN/A
GPCR-HGmod modelQ8TCW9
3D structure modelThis predicted structure model is from GPCR-EXP Q8TCW9.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5649
IUPHAR335
DrugBankN/A

Ligand

NameCHEMBL3900223
Molecular formulaC18H25N3O3S
IUPAC name4-(2,6-dimethylphenoxy)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine
Molecular weight363.476
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.1
Synonyms1-(3,5-Dimethyl-1H-pyrazole-4-sulfonyl)-4-(2,6-dimethylphenoxyl)piperidine
SCHEMBL15549545
US9475795, 38
1-(3,5-Dimethyl-1H-pyrazole-4-sulfonyl)-4-(2,6-dimethylphenoxy)piperidine
BDBM250559
[ Show all ]
Inchi KeyFGVBKKDHMNXMNK-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H25N3O3S/c1-12-6-5-7-13(2)17(12)24-16-8-10-21(11-9-16)25(22,23)18-14(3)19-20-15(18)4/h5-7,16H,8-11H2,1-4H3,(H,19,20)
PubChem CID72550005
ChEMBLCHEMBL3900223
IUPHARN/A
BindingDB250559
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC503200.0 nM, NoneBindingDB,ChEMBL

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