Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.36 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | LYN | P07948 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29274133 | 0.83 | MEN1 (0.50) | GAAMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL29274130 | 0.76 | MAPT (0.38) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL29274137 | 0.73 | ALDH1A1 (0.33) | KDM4EALDH1A1MAPTHPGDRAB9A | |
| SCHEMBL30761103 | 0.72 | MEN1 (0.42) | MAPTMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL29274141 | 0.69 | LPAR1 (0.35) | KMT2APOLBSMN1; SMN2MAPK1 | |
| SCHEMBL23997404 | 0.67 | PDE10A (0.41) | PDE10A | |
| SCHEMBL13689760 | 0.65 | KMT2A (0.66) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL21666863 | 0.65 | RAB9A (0.59) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL4946668 | 0.65 | KDM4E (0.60) | KDM4EALDH1A1MAPTGAAMEN1 | |
| SCHEMBL21386707 | 0.64 | MAPK10 (0.46) | KDM4EMAPTPOLBMAPK1PIK3CA |
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-117105934-A | Method for preparing benzodiazepine compound by selective hydrogenation | 石河子大学 | 2023-11-24 | — | — | CN | disclosed |