Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | MAN2B1 | O00754 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
| ▸ | STK17B | O94768 | 1/20 | 0.36 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28870439 | 1.00 | EPHX1 (0.50) | EPHX1TDP1GAAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6310465 | 0.91 | TDP1 (0.46) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL13627401 | 0.85 | EPHX1 (0.62) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL15381857 | 0.84 | EPHX1 (0.51) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL28280065 | 0.83 | KMT2A (0.42) | MEN1KMT2AMAPK1 | |
| SCHEMBL24435259 | 0.82 | EPHX1 (0.58) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL26043679 | 0.82 | EPHX1 (0.62) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL851615 | 0.82 | TDP1 (0.56) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL12894206 | 0.81 | EPHX1 (0.65) | EPHX1TDP1GAAMEN1KMT2A | |
| SCHEMBL24435431 | 0.81 | EPHX1 (0.65) | EPHX1TDP1GAAMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109415355-A | Benzdioxan derivative and its medicinal usage | 奥赖恩公司 | 2019-03-01 | — | — | CN | disclosed |