Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28090836 | 0.89 | HDAC1 (0.51) | KMT2AMEN1HDAC1P2RX7NPC1 | |
| SCHEMBL28090831 | 0.85 | MAPK14 (0.52) | KMT2AMEN1HDAC1ALOX15P2RX7 | |
| SCHEMBL28090523 | 0.85 | MAPT (0.44) | HTTKMT2AMEN1HDAC1P2RX7 | |
| SCHEMBL28090536 | 0.85 | SMN1; SMN2 (0.50) | HTTKMT2AMEN1HDAC1ALOX15 | |
| SCHEMBL23354766 | 0.83 | ALDH1A1 (0.46) | HDAC1P2RX7NPC1RAB9ANTRK1 | |
| SCHEMBL28090559 | 0.82 | MAPK14 (0.55) | HTTKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28090834 | 0.82 | HDAC1 (0.49) | KMT2AMEN1HDAC1P2RX7NPC1 | |
| SCHEMBL28090668 | 0.79 | KMT2A (0.39) | HTTKMT2AMEN1HDAC1ALOX15 | |
| SCHEMBL28090837 | 0.75 | ALDH1A1 (0.57) | HTTKMT2AMEN1HDAC1MAPT | |
| SCHEMBL28832952 | 0.73 | ADORA2A (0.42) | HTTKMT2AMEN1HDAC1NPC1 |
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 |