Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.58 |
| ▸ | CYP1A1 | P04798 | 8/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 8/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | STAT6 | P42226 | 1/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.44 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.44 |
| ▸ | PRKDC | P78527 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9328729 | 0.89 | CYP2D6 (0.49) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL9327900 | 0.88 | CYP1A2 (0.56) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL9328614 | 0.87 | CYP1A2 (0.59) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL12835505 | 0.85 | CYP1A2 (0.56) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL9327677 | 0.85 | CYP2D6 (0.53) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL12835292 | 0.85 | CYP2D6 (0.51) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL12835503 | 0.85 | CYP1A2 (0.60) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| Mitoflaxone SCHEMBL106705 | 0.85 | CYP1A2 (0.62) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL7083117 | 0.84 | CYP1A2 (0.59) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 | |
| SCHEMBL9327573 | 0.84 | GLA (0.46) | CYP1A2CYP1A1CYP1B1CYP2D6CYP3A4 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0454728-B1 | FLUORINATED FLAVONE ACETIC ACID | UPJOHN CO (US) | 1994-03-16 | — | — | EP | claimed |
| US-5238954-A | Antitumor agents | THE UPJOHN COMPANY (US) | 1993-08-24 | — | — | US | claimed |
| EP-0454728-A1 | FLUORINATED FLAVONE ACETIC ACID. | UPJOHN CO (US) | 1991-11-06 | — | — | EP | claimed |
| WO-1990008143-A1 | FLUORINATED FLAVONE ACETIC ACID | THE UPJOHN COMPANY (US) | 1990-07-26 | — | — | WO | claimed |
| EP-0454728-B1 | FLUORINATED FLAVONE ACETIC ACID | UPJOHN CO (US) | 1994-03-16 | — | — | EP | disclosed |
| US-5238954-A | Antitumor agents | THE UPJOHN COMPANY (US) | 1993-08-24 | — | — | US | disclosed |
| EP-0454728-A1 | FLUORINATED FLAVONE ACETIC ACID. | UPJOHN CO (US) | 1991-11-06 | — | — | EP | disclosed |
| WO-1990008143-A1 | FLUORINATED FLAVONE ACETIC ACID | THE UPJOHN COMPANY (US) | 1990-07-26 | — | — | WO | disclosed |