Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MIF | P14174 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6962447 | 0.83 | SMN1; SMN2 (0.41) | ADORA3ADORA2AADORA1SMN1; SMN2POLB | |
| SCHEMBL7397801 | 0.73 | SMN1; SMN2 (0.54) | ADORA3PGRNPC1SMN1; SMN2POLB | |
| SCHEMBL8535277 | 0.71 | BCL2 (0.38) | ADORA3ADORA2AADORA1NPC1SMN1; SMN2 | |
| SCHEMBL6958076 | 0.71 | SMN1; SMN2 (0.58) | ADORA3PGRNPC1SMN1; SMN2POLB | |
| SCHEMBL6965057 | 0.71 | SMN1; SMN2 (0.46) | SMN1; SMN2POLBL3MBTL1CYP19A1KDM4E | |
| SCHEMBL6965119 | 0.71 | SMN1; SMN2 (0.46) | ADORA3PGRSMN1; SMN2POLBL3MBTL1 | |
| SCHEMBL6964231 | 0.70 | EDNRA (0.51) | NPC1SMN1; SMN2POLBL3MBTL1CYP19A1 | |
| SCHEMBL6965799 | 0.69 | PTGES (0.51) | ADORA3ADORA2AADORA1NPC1SMN1; SMN2 | |
| SCHEMBL6965164 | 0.68 | ABCG2 (0.45) | SMN1; SMN2POLBL3MBTL1RAB9AKDM4E | |
| SCHEMBL8535881 | 0.67 | ABCB1 (0.45) | ADORA3ADORA2AADORA1SMN1; SMN2POLB |
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-0729466-A1 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1996-09-04 | — | — | EP | disclosed |
| WO-1995014014-A2 | PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS | PARKE, DAVIS & COMPANY (US) | 1995-05-26 | — | — | WO | disclosed |