Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.62 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.62 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.62 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.62 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.62 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | GRM4 | Q14833 | 5/20 | 0.57 |
| ▸ | MEN1 | O00255 | 5/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL20302203 | 0.87 | MCL1 (0.69) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL28871761 | 0.86 | TLR7 (0.57) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL28442197 | 0.84 | NPC1 (0.76) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL7989152 | 0.84 | HDAC1 (0.77) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL31087272 | 0.82 | NPC1 (0.59) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL5697349 | 0.81 | GRM4 (0.69) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL14082248 | 0.81 | RAB9A (0.69) | RAB9ANPC1MEN1KMT2ALMNA | |
| SCHEMBL4522324 | 0.79 | HDAC1 (0.69) | ALDH1A1HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL22208965 | 0.79 | HDAC6 (0.59) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL14083483 | 0.79 | MEN1 (0.67) | ALDH1A1HDAC1RAB9ANPC1MEN1 |
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-115108978-B | Pyridine formylhydrazine plant antifungal medicine | 西北农林科技大学 | 2024-05-24 | — | — | CN | disclosed |