Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.74 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.74 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 6/20 | 0.63 |
| ▸ | MAPT | P10636 | 4/20 | 0.60 |
| ▸ | GAA | P10253 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13655506 | 0.84 | MEN1 (0.58) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL14950924 | 0.79 | MEN1 (0.69) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL12790100 | 0.78 | MEN1 (1.00) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL4298838 | 0.78 | MEN1 (0.69) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL4291809 | 0.76 | MEN1 (0.67) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL4287073 | 0.75 | MEN1 (0.68) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL13610019 | 0.75 | KDM4E (0.56) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL14941627 | 0.73 | MEN1 (0.84) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL4295578 | 0.73 | MEN1 (0.65) | ALDH1A1KDM4EHSD17B10USP2MEN1 | |
| SCHEMBL4294557 | 0.73 | ALDH1A1 (0.64) | ALDH1A1KDM4EHSD17B10USP2MEN1 |
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-109734676-B | Benzodiazepine derivative and preparation method and application thereof | 四川大学 | 2021-01-29 | — | — | CN | disclosed |