cyclo[2Abz-D-Pro-D-N(Me)Phe-Ala-D-Val]
| Internal ID | 8e14a1f9-1592-4a65-a457-7c3a2274e247 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Oligopeptides |
| IUPAC Name | (7R,10R,13S,16R)-10-benzyl-9,13-dimethyl-16-propan-2-yl-3,9,12,15,18-pentazatricyclo[17.4.0.03,7]tricosa-1(23),19,21-triene-2,8,11,14,17-pentone |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H37N5O5/c1-18(2)25-28(38)32-22-14-9-8-13-21(22)29(39)35-16-10-15-23(35)30(40)34(4)24(17-20-11-6-5-7-12-20)27(37)31-19(3)26(36)33-25/h5-9,11-14,18-19,23-25H,10,15-17H2,1-4H3,(H,31,37)(H,32,38)(H,33,36)/t19-,23+,24+,25+/m0/s1 |
| InChI Key | DEXQLMIHCYVILW-ZPOKTZCFSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C30H37N5O5 |
| Molecular Weight | 547.60 g/mol |
| Exact Mass | 547.27946930 g/mol |
| Topological Polar Surface Area (TPSA) | 128.00 Ų |
| XlogP | 2.90 |
| There are no found synonyms. |
![2D Structure of cyclo[2Abz-D-Pro-D-N(Me)Phe-Ala-D-Val]](https://plantaedb.com/storage/docs/compounds/2023/11/cyclo2abz-d-pro-d-nmephe-ala-d-val.jpg "2D Structure of cyclo[2Abz-D-Pro-D-N(Me)Phe-Ala-D-Val]")
| 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 | 99.91% | 98.95% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 98.32% | 85.14% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.19% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.26% | 95.56% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 95.74% | 97.25% |
| CHEMBL333 | P08253 | Matrix metalloproteinase-2 | 95.33% | 96.31% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 95.10% | 90.08% |
| CHEMBL1902 | P62942 | FK506-binding protein 1A | 94.09% | 97.05% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 93.85% | 93.03% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 92.42% | 97.64% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 91.11% | 95.89% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 89.81% | 95.93% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 89.52% | 82.69% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 88.21% | 90.17% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 87.77% | 94.75% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 87.24% | 90.71% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 86.79% | 91.11% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 86.10% | 98.33% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 85.52% | 86.33% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 84.83% | 97.09% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 84.69% | 93.00% |
| CHEMBL5805 | Q9NR97 | Toll-like receptor 8 | 83.37% | 96.25% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 83.30% | 96.47% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 82.22% | 90.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.49% | 99.23% |
| CHEMBL4523377 | Q86WV6 | Stimulator of interferon genes protein | 81.17% | 95.48% |
| CHEMBL3524 | P56524 | Histone deacetylase 4 | 80.80% | 92.97% |
| CHEMBL264 | Q9Y5N1 | Histamine H3 receptor | 80.60% | 91.43% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 80.52% | 97.14% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 162973440 |
| LOTUS | LTS0123899 |
| wikiData | Q104977668 |