H-DL-Lys(Bz(2,3-diOH))(Bz(2,3-diOH))-DL-Lys(Bz(2,3-diOH))(Bz(2,3-diOH))-DL-Phe-OH
| Internal ID | 48795067-cb7b-4852-a150-d2d119f7f9a1 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Oligopeptides |
| IUPAC Name | 2-[[2-[[2-amino-6-[(2,3-dihydroxybenzoyl)amino]hexanoyl]amino]-6-[(2,3-dihydroxybenzoyl)amino]hexanoyl]amino]-3-phenylpropanoic acid |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C35H43N5O10/c36-24(14-4-6-18-37-31(45)22-12-8-16-27(41)29(22)43)33(47)39-25(34(48)40-26(35(49)50)20-21-10-2-1-3-11-21)15-5-7-19-38-32(46)23-13-9-17-28(42)30(23)44/h1-3,8-13,16-17,24-26,41-44H,4-7,14-15,18-20,36H2,(H,37,45)(H,38,46)(H,39,47)(H,40,48)(H,49,50) |
| InChI Key | ASZMRCGOWFMPCF-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C35H43N5O10 |
| Molecular Weight | 693.70 g/mol |
| Exact Mass | 693.30099259 g/mol |
| Topological Polar Surface Area (TPSA) | 261.00 Ų |
| XlogP | 1.10 |
| There are no found synonyms. |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 99.52% | 98.95% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 98.40% | 90.20% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 96.03% | 90.17% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.93% | 91.11% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 95.44% | 93.56% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 94.69% | 98.33% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.45% | 96.09% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 93.04% | 100.00% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 92.71% | 95.50% |
| CHEMBL3891 | P07384 | Calpain 1 | 92.29% | 93.04% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 91.02% | 99.17% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 90.87% | 100.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 90.87% | 95.56% |
| CHEMBL2321614 | Q9NPC2 | Potassium channel subfamily K member 9 | 87.81% | 80.00% |
| CHEMBL4101 | P17612 | cAMP-dependent protein kinase alpha-catalytic subunit | 87.47% | 82.86% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 87.47% | 91.81% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 86.82% | 100.00% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 86.55% | 95.17% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 86.28% | 94.45% |
| CHEMBL5261 | Q7L7X3 | Serine/threonine-protein kinase TAO1 | 85.64% | 89.33% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 85.42% | 96.67% |
| CHEMBL2327 | P21452 | Neurokinin 2 receptor | 84.96% | 98.89% |
| CHEMBL4361 | Q07820 | Induced myeloid leukemia cell differentiation protein Mcl-1 | 84.73% | 95.52% |
| CHEMBL2535 | P11166 | Glucose transporter | 83.98% | 98.75% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 82.05% | 91.19% |
| CHEMBL1907594 | P30926 | Neuronal acetylcholine receptor; alpha3/beta4 | 82.04% | 97.23% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 81.28% | 94.73% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 80.93% | 99.15% |
| CHEMBL2096618 | P11274 | Bcr/Abl fusion protein | 80.90% | 85.83% |
| CHEMBL3392948 | Q9NP59 | Solute carrier family 40 member 1 | 80.56% | 95.00% |
| CHEMBL3230 | O95977 | Sphingosine 1-phosphate receptor Edg-6 | 80.43% | 94.01% |
| CHEMBL5847 | P52895 | Aldo-keto reductase family 1 member C2 | 80.12% | 92.50% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
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| There are no matching plants. |
| PubChem | 162941178 |
| LOTUS | LTS0132312 |
| wikiData | Q103816404 |