Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.83 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.83 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.83 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.83 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Phenacyl Chloride SCHEMBL55444 | 0.91 | ALDH1A1 (1.00) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL2314766 | 0.91 | ALDH1A1 (1.00) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL4787265 | 0.89 | ALDH1A1 (0.86) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL28256528 | 0.89 | ALDH1A1 (0.95) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL5139857 | 0.89 | ALDH1A1 (0.95) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL27611889 | 0.89 | ALDH1A1 (0.95) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL28034037 | 0.89 | ALDH1A1 (0.95) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL14715802 | 0.89 | ALDH1A1 (0.95) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL9451036 | 0.87 | ALDH1A1 (0.83) | GSK3BALDH1A1MAPK1HIF1ATRPA1 | |
| Phenacyl Chloride SCHEMBL27802062 | 0.86 | ALDH1A1 (0.91) | GSK3BALDH1A1MAPK1HIF1ATRPA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107362228-A | One kind preventing and treating periapicalitis Chinese traditional medicine tooth powder technique | 何家平 | 2017-11-21 | — | — | CN | disclosed |
| EP-1007528-B1 | ROBUSTAFLAVONE, INTERMEDIATES AND ANALOGUES AND METHOD FOR PREPARATION THEREOF | ADVANCED LIFE SCIENCES INC (US) | 2003-11-26 | — | — | EP | disclosed |
| US-6225481-B1 | REACTING 6-IODO-5,7,4'-TRIMETHOXYFLAVONE AND 5,7-4'-TRIMETHOXY-3'-(TRIMETHYLSTANNYL)FLAVONE IN PRESENCE OF PALLADIUM COMPOUND AND BASE TO PRODUCE ROBUSTAFLAVONE HEXAMETHYL ETHER, DEMETHYLATING TO PRODUCE ROBUSTAFLAVONE | ADVANCED LIFE SCIENCES, INC. | 2001-05-01 | — | — | US | disclosed |
| CN-1274354-A | Robustaflavone, intermediates and analogues and method for prepn. method | MEDICHEM RES INC (US) | 2000-11-22 | — | — | CN | disclosed |
| EP-1007528-A2 | ROBUSTAFLAVONE, INTERMEDIATES AND ANALOGUES AND METHOD FOR PREPARATION THEREOF | MEDICHEM RESEARCH, INC. (US) | 2000-06-14 | — | — | EP | disclosed |
| WO-1999010292-A2 | ROBUSTAFLAVONE, INTERMEDIATES AND ANALOGUES AND METHOD FOR PREPARATION THEREOF | MEDICHEM RESEARCH, INC. (US) | 1999-03-04 | — | — | WO | disclosed |