Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | NCS1 | P62166 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20101035 | 0.87 | HSP90AA1 (0.54) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17985744 | 0.84 | ALDH1A1 (0.65) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL20101038 | 0.83 | HSP90AA1 (0.71) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17963013 | 0.72 | HSP90AA1 (0.57) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17985747 | 0.69 | HSP90AA1 (0.76) | HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A | |
| SCHEMBL17987878 | 0.69 | HSP90AA1 (0.55) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL20101082 | 0.68 | HSP90AA1 (0.85) | HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A | |
| SCHEMBL17987886 | 0.68 | HSP90AA1 (0.54) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL20101036 | 0.67 | HSP90AA1 (0.76) | HSP90AA1ALDH1A1CYP1A2CYP3A4HIF1A | |
| SCHEMBL17963015 | 0.66 | HSP90AA1 (0.65) | DYRK1AHSP90AA1ALDH1A1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018081612-A1 | COMPOUNDS AND METHODS FOR TREATING CANCER | ACTAVALON, INC. (US) | 2018-05-03 | — | — | WO | disclosed |