Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28090668 | 0.79 | KMT2A (0.39) | MAPK14KMT2AHDAC1ALDH1A1CNR2 | |
| SCHEMBL28832952 | 0.79 | ADORA2A (0.42) | MAPK14KMT2AHDAC1ALDH1A1CNR2 | |
| SCHEMBL28090834 | 0.78 | HDAC1 (0.49) | MAPK14KMT2AHDAC1ALDH1A1VNN1 | |
| SCHEMBL28090833 | 0.78 | ADORA2A (0.45) | KMT2AHDAC1ALDH1A1MEN1TDP1 | |
| SCHEMBL28090836 | 0.76 | HDAC1 (0.51) | MAPK14KMT2AHDAC1ALDH1A1CNR2 | |
| SCHEMBL28090831 | 0.70 | MAPK14 (0.52) | MAPK14KMT2AHDAC1ALDH1A1NPC1 | |
| SCHEMBL28090523 | 0.70 | MAPT (0.44) | KMT2AHDAC1ALDH1A1CNR2NPC1 | |
| SCHEMBL28090835 | 0.70 | HTT (0.47) | MAPK14KMT2AHDAC1ALDH1A1NPC1 | |
| SCHEMBL30332432 | 0.69 | HCRTR1 (0.39) | — | |
| SCHEMBL28090536 | 0.68 | SMN1; SMN2 (0.50) | MAPK14KMT2AHDAC1ALDH1A1NPC1 |
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 |