Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.74 |
| ▸ | LMNA | P02545 | 1/20 | 0.74 |
| ▸ | TP53 | P04637 | 1/20 | 0.74 |
| ▸ | GPR183 | P32249 | 12/20 | 0.62 |
| ▸ | MAOB | P27338 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL29188746 | 1.00 | ALDH1A1 (0.74) | ALDH1A1LMNATP53GPR183MAOB | |
| SCHEMBL29188696 | 0.84 | ALDH1A1 (0.79) | ALDH1A1LMNATP53GPR183NPC1 | |
| SCHEMBL29188695 | 0.84 | ALDH1A1 (0.79) | ALDH1A1LMNATP53GPR183NPC1 | |
| SCHEMBL28451368 | 0.84 | ALDH1A1 (0.53) | ALDH1A1LMNATP53GPR183KMT2A | |
| SCHEMBL11479552 | 0.84 | MAPT (0.74) | ALDH1A1LMNATP53GPR183NPC1 | |
| SCHEMBL11479548 | 0.84 | MAPT (0.74) | ALDH1A1LMNATP53GPR183NPC1 | |
| SCHEMBL26487841 | 0.84 | GPR183 (0.65) | GPR183 | |
| SCHEMBL2909559 | 0.83 | KMT2A (0.73) | ALDH1A1LMNAGPR183NPC1RAB9A | |
| SCHEMBL2909561 | 0.83 | KMT2A (0.73) | ALDH1A1LMNAGPR183NPC1RAB9A | |
| SCHEMBL16599253 | 0.83 | GPR183 (0.63) | ALDH1A1LMNATP53GPR183MAOB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110498761-B | Application of acetyl amantadine piperazine (pyridine) compound as cerebral nerve protective agent | 上海医药工业研究院 | 2022-09-13 | — | — | CN | claimed |
| CN-110498761-B | Application of acetyl amantadine piperazine (pyridine) compound as cerebral nerve protective agent | 上海医药工业研究院 | 2022-09-13 | — | — | CN | disclosed |