Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.31 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL987648 | 0.91 | CYP3A4 (0.48) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL1220674 | 0.84 | TP53 (0.43) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL29108682 | 0.83 | ALDH1A1 (0.42) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL1326381 | 0.81 | TSHR (0.43) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL27351320 | 0.81 | PEPD (0.42) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL3290514 | 0.79 | EPHX1 (0.44) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL423861 | 0.79 | TSHR (0.38) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL1326244 | 0.79 | KMT2A (0.40) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL1326038 | 0.79 | TSHR (0.38) | CYP3A4TP53ALDH1A1GAATSHR | |
| SCHEMBL9285973 | 0.78 | CYP3A4 (0.41) | CYP3A4TP53ALDH1A1GAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5068365-A | Herbicides | TOSOH CORPORATION (JP) | 1991-11-26 | — | — | US | disclosed |
| EP-0326764-A2 | Hexahydrophthalic anilide derivatives and herbicide compositions containing the same | Tosoh Corporation (JP) | 1989-08-09 | — | — | EP | disclosed |