Ala-Leu-Asp-Asp
| Internal ID | 1c5d0f72-6c09-4efd-b05c-28abbc502a58 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Oligopeptides |
| IUPAC Name | (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylpentanoyl]amino]-3-carboxypropanoyl]amino]butanedioic acid |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C17H28N4O9/c1-7(2)4-9(19-14(26)8(3)18)15(27)20-10(5-12(22)23)16(28)21-11(17(29)30)6-13(24)25/h7-11H,4-6,18H2,1-3H3,(H,19,26)(H,20,27)(H,21,28)(H,22,23)(H,24,25)(H,29,30)/t8-,9-,10-,11-/m0/s1 |
| InChI Key | GHBSKQGCIYSCNS-NAKRPEOUSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C17H28N4O9 |
| Molecular Weight | 432.40 g/mol |
| Exact Mass | 432.18562848 g/mol |
| Topological Polar Surface Area (TPSA) | 225.00 Ų |
| XlogP | -5.30 |
| ALDD |
| A-L-D-D |
| L-Ala-L-Leu-L-Asp-L-Asp |
| SCHEMBL29382762 |
| CHEBI:73355 |
| L-alanyl-L-leucyl-L-alpha-aspartyl-L-aspartic acid |
| Q27140459 |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 98.96% | 83.82% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 98.03% | 90.17% |
| CHEMBL2581 | P07339 | Cathepsin D | 97.80% | 98.95% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 95.90% | 93.56% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.28% | 96.09% |
| CHEMBL3468 | P55210 | Caspase-7 | 94.82% | 95.68% |
| CHEMBL3776 | Q14790 | Caspase-8 | 94.53% | 97.06% |
| CHEMBL4801 | P29466 | Caspase-1 | 94.37% | 96.85% |
| CHEMBL3837 | P07711 | Cathepsin L | 94.35% | 96.61% |
| CHEMBL2334 | P42574 | Caspase-3 | 92.84% | 98.25% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 92.06% | 90.20% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 91.13% | 100.00% |
| CHEMBL236 | P41143 | Delta opioid receptor | 90.61% | 99.35% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 90.09% | 99.17% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 88.31% | 92.29% |
| CHEMBL237 | P41145 | Kappa opioid receptor | 86.82% | 98.10% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 86.80% | 96.47% |
| CHEMBL3308 | P55212 | Caspase-6 | 86.71% | 97.56% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 84.22% | 96.95% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 83.67% | 100.00% |
| CHEMBL5285 | Q99683 | Mitogen-activated protein kinase kinase kinase 5 | 83.00% | 92.26% |
| CHEMBL4618 | P09960 | Leukotriene A4 hydrolase | 82.81% | 97.86% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 82.55% | 96.00% |
| CHEMBL2095164 | P49354 | Geranylgeranyl transferase type I | 82.48% | 92.80% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 81.51% | 100.00% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 80.39% | 94.33% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 80.39% | 98.33% |
| CHEMBL2094135 | Q96BI3 | Gamma-secretase | 80.13% | 98.05% |
| CHEMBL3830 | Q2M2I8 | Adaptor-associated kinase | 80.03% | 83.10% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 71464650 |
| LOTUS | LTS0072726 |
| wikiData | Q27140459 |