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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

NameCHEMBL3966784
Molecular formulaC17H21Cl2N3O2S
IUPAC name1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-4-[(4-chlorophenyl)methyl]piperidine
Molecular weight402.334
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.1
SynonymsSCHEMBL15549113
1-((5-Chloro-1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-4-(4 chlorobenzyl)piperidine
US9475795, 68
BDBM250589
1-((5-Chloro-1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-4-(4chlorobenzyl)piperidine
[ Show all ]
Inchi KeyBOTHEIGTHCWZNG-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H21Cl2N3O2S/c1-12-16(17(19)21(2)20-12)25(23,24)22-9-7-14(8-10-22)11-13-3-5-15(18)6-4-13/h3-6,14H,7-11H2,1-2H3
PubChem CID72550668
ChEMBLCHEMBL3966784
IUPHARN/A
BindingDB250589
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC502020.0 nM, NoneBindingDB,ChEMBL

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