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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

NameCHEMBL3905529
Molecular formulaC18H24ClN3O3S
IUPAC name1-(4-chlorophenyl)-1-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]ethanol
Molecular weight397.918
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.6
SynonymsBDBM250622
FSRMRNHKSUCZDY-UHFFFAOYSA-N
1-(4-Chlorophenyl)-1-(1-((3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl)piperidin-4-yl)ethanol
SCHEMBL15550186
US9475795, 101
Inchi KeyFSRMRNHKSUCZDY-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H24ClN3O3S/c1-12-17(13(2)21-20-12)26(24,25)22-10-8-15(9-11-22)18(3,23)14-4-6-16(19)7-5-14/h4-7,15,23H,8-11H2,1-3H3,(H,20,21)
PubChem CID72547906
ChEMBLCHEMBL3905529
IUPHARN/A
BindingDB250622
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC502380.0 nM, NoneBindingDB,ChEMBL

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