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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

NameCHEMBL3622090
Molecular formulaC18H20ClFN4O
IUPAC name[3-(5-chloro-3-methylpyridin-2-yl)-3-fluoropiperidin-1-yl]-[2-(methylamino)pyridin-4-yl]methanone
Molecular weight362.833
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.8
SynonymsBDBM50121328
SCHEMBL16760290
Inchi KeyKJJXBCYIKIOANE-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20ClFN4O/c1-12-8-14(19)10-23-16(12)18(20)5-3-7-24(11-18)17(25)13-4-6-22-15(9-13)21-2/h4,6,8-10H,3,5,7,11H2,1-2H3,(H,21,22)
PubChem CID91799673
ChEMBLCHEMBL3622090
IUPHARN/A
BindingDB50121328
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50290.0 nMPMID26286844BindingDB,ChEMBL

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