Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | DHODH | Q02127 | 2/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HAAO | P46952 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3969049 | 0.84 | CA12 (0.42) | METAP2ALDH1A1HSD17B10KDM4EMAPK1 | |
| SCHEMBL5772028 | 0.81 | TSHR (0.52) | SMN1; SMN2ALDH1A1HSD17B10KDM4EMAPK1 | |
| SCHEMBL139141 | 0.81 | CYP1A2 (0.44) | METAP2MCL1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL29400914 | 0.81 | CYP1A2 (0.44) | METAP2MCL1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL17746669 | 0.79 | TSHR (0.42) | CYP3A4CYP1A2CYP2C9ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL302925 | 0.79 | HAAO (0.42) | METAP2MCL1CYP3A4CYP1A2CYP2C9 | |
| Benzene SCHEMBL28845411 | 0.79 | ALDH1A1 (0.46) | METAP2MCL1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL27286816 | 0.78 | ABL1 (0.33) | ALDH1A1HSD17B10KDM4EKMT2AHPGD | |
| SCHEMBL10871292 | 0.77 | CYP1A2 (0.41) | SMN1; SMN2CYP1A2ALDH1A1HSD17B10KDM4E | |
| Cyclohexane SCHEMBL4564741 | 0.76 | HAAO (0.40) | METAP2MCL1CYP3A4CYP1A2CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0405389-A1 | Process for producing an aromatic compound | Mitsubishi Chemical Corporation (JP) | 1991-01-02 | — | — | EP | claimed |
| EP-0405389-A1 | Process for producing an aromatic compound | Mitsubishi Chemical Corporation (JP) | 1991-01-02 | — | — | EP | disclosed |