Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPOX | P50336 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 8/20 | 0.42 |
| ▸ | MAOB | P27338 | 8/20 | 0.42 |
| ▸ | GRM5 | P41594 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CASP2 | P42575 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16230329 | 0.81 | PPOX (0.52) | PPOXGSK3BCYP3A4TDP1MAOA | |
| SCHEMBL8529440 | 0.76 | PPOX (0.47) | PPOXGSK3BCYP3A4TDP1MAOA | |
| SCHEMBL29376322 | 0.75 | TDP1 (0.46) | CYP3A4TDP1ALDH1A1KDM4E | |
| SCHEMBL92283 | 0.75 | TDP1 (0.46) | CYP3A4TDP1ALDH1A1KDM4E | |
| SCHEMBL11420803 | 0.75 | MAOA (0.63) | PPOXGSK3BCYP3A4TDP1MAOA | |
| SCHEMBL11420801 | 0.75 | MAOA (0.63) | PPOXGSK3BCYP3A4TDP1MAOA | |
| SCHEMBL21052525 | 0.72 | CA1 (0.55) | TDP1ALDH1A1 | |
| SCHEMBL20814168 | 0.72 | ALDH1A1 (0.50) | ALDH1A1CASP3KDM4EMAPT | |
| SCHEMBL15906657 | 0.72 | MAOA (0.48) | PPOXGSK3BCYP3A4TDP1MAOA | |
| SCHEMBL27632036 | 0.71 | PPOX (0.56) | PPOXGSK3BCYP3A4TDP1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011037610-A1 | PROSTAGLANDIN TRANSPORTER INHIBITORS AND USES THEREOF | ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) | 2011-03-31 | — | — | WO | disclosed |
| EP-1338416-B1 | Method for making lithographic printing plate | FUJIFILM CORP (JP) | 2007-09-05 | — | — | EP | disclosed |
| US-4144072-A | CONTAINING A PHTHALAZINONE AND A PHTHALIMIDE | FUJI PHOTO FILM CO., LTD. (JP) | 1979-03-13 | — | — | US | disclosed |