Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.58 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.52 |
| ▸ | RUNX1 | Q01196 | 5/20 | 0.44 |
| ▸ | CBFB | Q13951 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL11903647 | 0.86 | TRPV1 (0.62) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL11903494 | 0.86 | TRPV1 (0.62) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL11903464 | 0.84 | TRPV1 (0.60) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL11903440 | 0.83 | TRPV1 (0.58) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL11903477 | 0.83 | TRPV1 (0.57) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL11903515 | 0.82 | TRPV1 (0.58) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL11903467 | 0.82 | TRPV1 (0.57) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL10766038 | 0.81 | NPBWR1 (0.58) | NPC1KDM4ERAB9APOLBNPBWR1 | |
| SCHEMBL11903644 | 0.81 | TRPV1 (0.56) | TRPV1CHEK2RUNX1CBFBNPC1 | |
| SCHEMBL13305849 | 0.80 | TRPV1 (0.55) | TRPV1CHEK2RUNX1CBFB |
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 |