Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.53 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL19011016 | 0.88 | NUDT1 (0.48) | NUDT1METAP2ALDH1A1MAOBALOX15 | |
| SCHEMBL26437908 | 0.87 | NUDT1 (0.51) | NUDT1METAP2PSMB5ALDH1A1MAOB | |
| SCHEMBL1636724 | 0.82 | AKR1B1 (0.39) | NUDT1ALDH1A1MAOBMAPTHPGD | |
| SCHEMBL8281383 | 0.80 | NPC1 (0.55) | NUDT1ALDH1A1ALOX15TSHRMAPT | |
| SCHEMBL12799818 | 0.80 | ALOX5 (0.50) | NUDT1ALDH1A1MAOBMAPK1MAPT | |
| SCHEMBL21157905 | 0.78 | NUDT1 (0.44) | NUDT1METAP2PSMB5ALDH1A1MAOB | |
| SCHEMBL12799826 | 0.78 | ALOX5 (0.48) | NUDT1ALDH1A1MAOBTSHRMAPK1 | |
| SCHEMBL17851236 | 0.78 | ALOX5 (0.48) | NUDT1ALDH1A1MAOBMAPTHPGD | |
| SCHEMBL1635618 | 0.77 | AKR1B1 (0.38) | NUDT1ALDH1A1MAOBALOX15TSHR | |
| SCHEMBL889806 | 0.77 | AVPR1A (0.44) | NUDT1ALDH1A1MAOBTSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9714253-B2 | Organic thin film transistor, organic semiconductor thin film, and organic semiconductor material | FUJIFILM CORPORATION (JP) | 2017-07-25 | — | — | US | disclosed |