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Name | Pyroglutamylated RF-amide peptide receptor |
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Species | Homo sapiens (Human) |
Gene | QRFPR |
Synonym | QRFP receptor peptide p518 receptor Orexigenic neuropeptide QRFP receptor GPR103 G-protein coupled receptor 103 [ Show all ] |
Disease | N/A |
Length | 431 |
Amino acid sequence | MQALNITPEQFSRLLRDHNLTREQFIALYRLRPLVYTPELPGRAKLALVLTGVLIFALALFGNALVFYVVTRSKAMRTVTNIFICSLALSDLLITFFCIPVTMLQNISDNWLGGAFICKMVPFVQSTAVVTEILTMTCIAVERHQGLVHPFKMKWQYTNRRAFTMLGVVWLVAVIVGSPMWHVQQLEIKYDFLYEKEHICCLEEWTSPVHQKIYTTFILVILFLLPLMVMLILYSKIGYELWIKKRVGDGSVLRTIHGKEMSKIARKKKRAVIMMVTVVALFAVCWAPFHVVHMMIEYSNFEKEYDDVTIKMIFAIVQIIGFSNSICNPIVYAFMNENFKKNVLSAVCYCIVNKTFSPAQRHGNSGITMMRKKAKFSLRENPVEETKGEAFSDGNIEVKLCEQTEEKKKLKRHLALFRSELAENSPLDSGH |
UniProt | Q96P65 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q96P65 |
3D structure model | This predicted structure model is from GPCR-EXP Q96P65. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL5852 |
IUPHAR | 333 |
DrugBank | N/A |
Name | CHEMBL1802416 |
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Molecular formula | C70H103N21O15 |
IUPAC name | (2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-N-[2-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]hexanamide |
Molecular weight | 1478.73 |
Hydrogen bond acceptor | 20 |
Hydrogen bond donor | 22 |
XlogP | -3.9 |
Synonyms | BDBM50347826 |
Inchi Key | IZXBKKCBCNQZLO-GXTUYBNASA-N |
Inchi ID | InChI=1S/C70H103N21O15/c71-30-12-10-22-48(84-62(100)49(23-11-13-31-72)85-63(101)50(24-14-32-79-69(75)76)87-67(105)55(40-92)90-60(98)47(73)34-45-26-28-46(94)29-27-45)61(99)82-38-57(95)81-39-58(96)83-53(36-43-18-6-2-7-19-43)65(103)91-56(41-93)68(106)89-54(37-44-20-8-3-9-21-44)66(104)86-51(25-15-33-80-70(77)78)64(102)88-52(59(74)97)35-42-16-4-1-5-17-42/h1-9,16-21,26-29,47-56,92-94H,10-15,22-25,30-41,71-73H2,(H2,74,97)(H,81,95)(H,82,99)(H,83,96)(H,84,100)(H,85,101)(H,86,104)(H,87,105)(H,88,102)(H,89,106)(H,90,98)(H,91,103)(H4,75,76,79)(H4,77,78,80)/t47-,48-,49-,50-,51-,52-,53-,54-,55-,56-/m0/s1 |
PubChem CID | 53363097 |
ChEMBL | CHEMBL1802416 |
IUPHAR | N/A |
BindingDB | 50347826 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
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EC50 | 138.0 nM | PMID21623631 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417