Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.49 |
| ▸ | GRIN1 | Q05586 | 6/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.44 |
| ▸ | CBFB | Q13951 | 3/20 | 0.44 |
| ▸ | RUNX1 | Q01196 | 3/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | UBE2N | P61088 | 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 | |
|---|---|---|---|---|
| SCHEMBL11903482 | 0.91 | GRIN1 (0.41) | PDE10AGRIN1GRIN2BTRPV1CACNA1B | |
| Hydrochloric Acid SCHEMBL11903476 | 0.81 | GRIN1 (0.53) | PDE10AGRIN1GRIN2BTRPV1CBFB | |
| Hydrochloric Acid SCHEMBL11903456 | 0.80 | GRIN1 (0.65) | PDE10AGRIN1GRIN2BTRPV1CBFB | |
| Hydrochloric Acid SCHEMBL11903596 | 0.79 | GAA (0.61) | PDE10AGRIN1GRIN2BTRPV1CBFB | |
| SCHEMBL11903493 | 0.76 | RUNX1 (0.58) | PDE10ATRPV1CBFBRUNX1SCN10A | |
| SCHEMBL10284557 | 0.76 | PDE10A (0.58) | PDE10AGRIN1GRIN2BTRPV1CBFB | |
| SCHEMBL11903504 | 0.74 | PDE10A (0.62) | PDE10AGRIN1GRIN2BTRPV1CBFB | |
| SCHEMBL15819760 | 0.73 | TRPV1 (0.52) | TRPV1 | |
| SCHEMBL11904659 | 0.73 | PDE10A (0.55) | PDE10AGRIN1GRIN2BTRPV1CBFB | |
| Hydrochloric Acid SCHEMBL11903522 | 0.72 | PDE10A (0.67) | PDE10AGRIN1GRIN2BTRPV1CBFB |
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-8293780-B1 | Anti-cancer agents based on 6-trifluoromethoxybenzimidazole derivatives and method of making | U.S. DEPARTMENT OF ENERGY (US) | 2012-10-23 | — | — | US | disclosed |
| US-8242284-B1 | Anti-cancer agents based on 6-trifluoromethoxybenzimidazole derivatives and method of making | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) | 2012-08-14 | — | — | US | disclosed |