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Name | Urotensin-2 receptor |
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Species | Homo sapiens (Human) |
Gene | UTS2R |
Synonym | urotensin II receptor UT receptor UR-II-R UR-2-R UII-R1 [ Show all ] |
Disease | Asthma Diabetic nephropathy Renal failure |
Length | 389 |
Amino acid sequence | MALTPESPSSFPGLAATGSSVPEPPGGPNATLNSSWASPTEPSSLEDLVATGTIGTLLSAMGVVGVVGNAYTLVVTCRSLRAVASMYVYVVNLALADLLYLLSIPFIVATYVTKEWHFGDVGCRVLFGLDFLTMHASIFTLTVMSSERYAAVLRPLDTVQRPKGYRKLLALGTWLLALLLTLPVMLAMRLVRRGPKSLCLPAWGPRAHRAYLTLLFATSIAGPGLLIGLLYARLARAYRRSQRASFKRARRPGARALRLVLGIVLLFWACFLPFWLWQLLAQYHQAPLAPRTARIVNYLTTCLTYGNSCANPFLYTLLTRNYRDHLRGRVRGPGSGGGRGPVPSLQPRARFQRCSGRSLSSCSPQPTDSLVLAPAAPARPAPEGPRAPA |
UniProt | Q9UKP6 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q9UKP6 |
3D structure model | This predicted structure model is from GPCR-EXP Q9UKP6. |
BioLiP | N/A |
Therapeutic Target Database | T49072 |
ChEMBL | CHEMBL3764 |
IUPHAR | 365 |
DrugBank | N/A |
Name | CHEMBL2372904 |
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Molecular formula | C61H80N12O18S2 |
IUPAC name | (4S)-4-amino-5-[[(2S,3R)-1-[(2R)-2-[[(2S)-3-carboxy-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(1S)-1-carboxy-2-methylpropyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid |
Molecular weight | 1333.5 |
Hydrogen bond acceptor | 21 |
Hydrogen bond donor | 18 |
XlogP | -1.9 |
Synonyms | N/A |
Inchi Key | DLYYRONXNNKUJL-JYDKZSAOSA-N |
Inchi ID | InChI=1S/C61H80N12O18S2/c1-30(2)49(61(90)91)71-58(87)45(29-93)70-55(84)40(24-34-16-18-36(75)19-17-34)65-51(80)31(3)64-53(82)42(25-35-27-63-39-14-9-8-13-37(35)39)67-54(83)41(23-33-11-6-5-7-12-33)66-57(86)44(28-92)69-56(85)43(26-48(78)79)68-59(88)46-15-10-22-73(46)60(89)50(32(4)74)72-52(81)38(62)20-21-47(76)77/h5-9,11-14,16-19,27,30-32,38,40-46,49-50,63,74-75,92-93H,10,15,20-26,28-29,62H2,1-4H3,(H,64,82)(H,65,80)(H,66,86)(H,67,83)(H,68,88)(H,69,85)(H,70,84)(H,71,87)(H,72,81)(H,76,77)(H,78,79)(H,90,91)/t31-,32+,38-,40-,41-,42-,43-,44-,45-,46+,49-,50-/m0/s1 |
PubChem CID | 73350313 |
ChEMBL | CHEMBL2372904 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|
EC50 | 14800.0 nM | PMID11960491 | ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417