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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

NameCHEMBL3895674
Molecular formulaC20H28ClN3O4S
IUPAC name4-[(4-chloro-2-methoxyphenyl)methyl]-4-methoxy-1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidine
Molecular weight441.971
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.0
Synonyms4-(4-Chloro-2-methoxybenzyl)-4-methoxy-1-((1,3,5-trimethyl-1H-pyrazol-4-yl)sulfonyl)piperidine
US9475795, 87
BDBM250608
KKZQKMYNFDBBBA-UHFFFAOYSA-N
SCHEMBL15549392
Inchi KeyKKZQKMYNFDBBBA-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H28ClN3O4S/c1-14-19(15(2)23(3)22-14)29(25,26)24-10-8-20(28-5,9-11-24)13-16-6-7-17(21)12-18(16)27-4/h6-7,12H,8-11,13H2,1-5H3
PubChem CID86704298
ChEMBLCHEMBL3895674
IUPHARN/A
BindingDB250608
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC505880.0 nM, NoneBindingDB,ChEMBL

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