Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.45 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.44 |
| ▸ | PDE7B | Q9NP56 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | ACLY | P53396 | 1/20 | 0.44 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9726177 | 1.00 | CYP1A2 (0.50) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL10511030 | 0.87 | TSHR (0.51) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL10511033 | 0.87 | TSHR (0.51) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL442788 | 0.85 | CYP1A2 (0.69) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL9452749 | 0.85 | CYP1A2 (0.69) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL7827901 | 0.84 | CYP1A2 (0.54) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| Hydrochloric Acid SCHEMBL11329805 | 0.84 | CYP1A2 (0.67) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL11329796 | 0.82 | NPC1 (0.52) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL29836060 | 0.81 | MAPK1 (0.52) | CYP1A2NPC1RAB9AMAPK1TSHR | |
| SCHEMBL535457 | 0.81 | MAPK1 (0.52) | CYP1A2NPC1RAB9AMAPK1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5141935-A | Dihydrobenz thiazine derivative and microorganism control agent | UBE INDUSTRIES, LTD. (JP) | 1992-08-25 | — | — | US | disclosed |
| EP-0162776-B1 | HETEROCYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS USEFUL AS ALDOSE REDUCTASE INHIBITORS CONTAINING THEM | LABORATOIRES UPSA (FR) | 1989-04-19 | — | — | EP | disclosed |
| EP-0162776-A2 | Heterocyclic derivatives, process for their preparation and medicaments useful as aldose reductase inhibitors containing them | LABORATOIRES UPSA (FR) | 1985-11-27 | — | — | EP | disclosed |