Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 5/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4186175 | 0.89 | — | — | |
| SCHEMBL1050730 | 0.81 | EPHX1 (0.40) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL1050728 | 0.81 | EPHX1 (0.40) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL12982309 | 0.81 | EPHX1 (0.40) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL13255290 | 0.81 | EPHX1 (0.40) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL24328846 | 0.81 | EPHX1 (0.40) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL18022827 | 0.79 | TP53 (0.46) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL16863975 | 0.79 | TP53 (0.46) | EPHX1CA12CA1CA2MMP2 | |
| SCHEMBL29074641 | 0.79 | EPHX1 (0.48) | EPHX1ALDH1A1NPSR1TP53 | |
| SCHEMBL17928476 | 0.78 | EPHX1 (0.37) | EPHX1CA12CA1CA2MMP2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3814362-A1 | IMMOBILIZED RUTHENIUM-TRIPHOS CATALYSTS FOR SELECTIVE HYDROGENOLYSIS OF AMIDES | Eastman Chemical Company (US) | 2021-05-05 | — | — | EP | disclosed |
| EP-3794004-A1 | MOLECULAR CATALYSTS FOR SELECTIVE HYDROGENOLYSIS OF AMIDES | Eastman Chemical Company (US) | 2021-03-24 | — | — | EP | disclosed |
| EP-2582705-A1 | ANELLATED PYRIDINE COMPOUNDS AS DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | F.HOFFMANN-LA ROCHE AG (CH) | 2013-04-24 | — | — | EP | disclosed |
| WO-2011161009-A1 | ANELLATED PYRIDINE COMPOUNDS AS DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-12-29 | — | — | WO | disclosed |
| EP-2066319-A1 | BENZOTRIAZOLE KINASE MODULATORS | F. Hoffmann-Roche AG (CH) | 2009-06-10 | — | — | EP | disclosed |
| WO-2008028860-A1 | BENZOTRIAZOLE KINASE MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-03-13 | — | — | WO | disclosed |