8-Demethoxy-10-deoxysteffimycinone
| Internal ID | c1dc62e4-d45d-4a72-8a57-89cdbee0bc98 |
| Taxonomy | Benzenoids > Naphthacenes > Tetracenequinones |
| IUPAC Name | 4,6,7,9-tetrahydroxy-2-methoxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H18O7/c1-20(26)6-8-3-10-16(18(24)14(8)13(22)7-20)19(25)15-11(17(10)23)4-9(27-2)5-12(15)21/h3-5,13,21-22,24,26H,6-7H2,1-2H3 |
| InChI Key | PFPVOQDOTFXBGN-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C20H18O7 |
| Molecular Weight | 370.40 g/mol |
| Exact Mass | 370.10525291 g/mol |
| Topological Polar Surface Area (TPSA) | 124.00 Ų |
| XlogP | 1.80 |
| SCHEMBL17354694 |
| CHEBI:207366 |
| 4,6,7,9-tetrahydroxy-2-methoxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione |
| 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 |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 99.53% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.20% | 96.09% |
| CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 96.02% | 96.38% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.71% | 98.95% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 94.43% | 91.07% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.16% | 95.56% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 94.11% | 99.15% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 93.09% | 96.21% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 91.98% | 90.00% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 91.54% | 92.68% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 91.25% | 89.00% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 89.61% | 95.93% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 89.37% | 96.77% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 89.16% | 94.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 88.97% | 99.23% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 88.63% | 92.94% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 88.43% | 95.89% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 85.87% | 95.89% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 85.79% | 94.45% |
| CHEMBL2179 | P04062 | Beta-glucocerebrosidase | 85.49% | 85.31% |
| CHEMBL4940 | P07195 | L-lactate dehydrogenase B chain | 84.81% | 95.53% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 84.42% | 97.14% |
| CHEMBL2056 | P21728 | Dopamine D1 receptor | 84.37% | 91.00% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 84.28% | 91.49% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 84.20% | 85.14% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 83.97% | 91.03% |
| CHEMBL2041 | P07949 | Tyrosine-protein kinase receptor RET | 83.09% | 91.79% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 83.02% | 91.19% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 82.81% | 97.09% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 82.78% | 82.69% |
| CHEMBL2964 | P36507 | Dual specificity mitogen-activated protein kinase kinase 2 | 82.12% | 80.00% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 82.03% | 94.75% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 81.90% | 86.33% |
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compound!
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| PubChem | 102111462 |
| LOTUS | LTS0053275 |
| wikiData | Q105207893 |