Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28832952 | 0.82 | ADORA2A (0.42) | KMT2ANPC1RAB9AHTTHDAC1 | |
| SCHEMBL28090836 | 0.80 | HDAC1 (0.51) | KMT2ANPC1RAB9AHDAC1MAPK14 | |
| SCHEMBL28090835 | 0.79 | HTT (0.47) | KMT2ANPC1RAB9AALOX15HTT | |
| SCHEMBL28090558 | 0.79 | MAPK14 (0.38) | KMT2ANPC1RAB9AHDAC1MAPK14 | |
| SCHEMBL28090536 | 0.76 | SMN1; SMN2 (0.50) | KMT2ANPC1RAB9AALOX15HTT | |
| SCHEMBL28832969 | 0.75 | KDM4E (0.47) | KMT2AHTTHDAC1MAPK14ALDH1A1 | |
| SCHEMBL28090831 | 0.73 | MAPK14 (0.52) | KMT2ANPC1RAB9AALOX15HDAC1 | |
| SCHEMBL28090523 | 0.73 | MAPT (0.44) | KMT2ANPC1RAB9AHTTHDAC1 | |
| SCHEMBL28090559 | 0.70 | MAPK14 (0.55) | KMT2ANPC1RAB9AHTTMAPK14 | |
| SCHEMBL28090834 | 0.70 | HDAC1 (0.49) | KMT2ANPC1RAB9AHDAC1MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106187923-A | 2 aryl 4 aroyl triazole compounds and application thereof | 沈阳药科大学 | 2016-12-07 | — | — | CN | disclosed |