Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.55 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6963657 | 0.89 | NPC1 (0.61) | TDP1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL3248092 | 0.82 | FFAR4 (0.55) | TDP1ESR1ESR2MAPTMAPK1 | |
| SCHEMBL864716 | 0.82 | MAPT (0.61) | TDP1NPC1RAB9AESR1ESR2 | |
| SCHEMBL11617258 | 0.81 | TDP1 (0.55) | TDP1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL27830157 | 0.81 | L3MBTL1 (0.50) | TDP1NPC1RAB9AESR1ESR2 | |
| SCHEMBL29050757 | 0.81 | MAPT (0.50) | TDP1NPC1RAB9AESR1ESR2 | |
| SCHEMBL657234 | 0.81 | TDP1 (0.55) | TDP1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL3884363 | 0.81 | FFAR4 (0.54) | TDP1ESR1ESR2MAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL7690739 | 0.81 | FFAR4 (0.54) | TDP1ESR1ESR2MAPTMAPK1 | |
| SCHEMBL2126591 | 0.79 | LMNA (0.56) | TDP1NPC1RAB9AMAPTKMT2A |
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-0729465-A1 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1996-09-04 | — | — | EP | disclosed |
| WO-1995014013-A1 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1995-05-26 | — | — | WO | disclosed |