Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7434596 | 0.65 | CTSL (0.36) | — | |
| SCHEMBL4718663 | 0.58 | CTSK (0.65) | — | |
| SCHEMBL21229023 | 0.53 | MEN1 (0.57) | ALDH1A1MEN1KMT2A | |
| SCHEMBL15709935 | 0.52 | MEN1 (0.73) | ALDH1A1MEN1KMT2A | |
| SCHEMBL17115640 | 0.52 | KMT2A (0.65) | ALDH1A1MEN1KMT2A | |
| SCHEMBL10931661 | 0.51 | UCHL1 (0.49) | ALDH1A1MEN1KMT2AUCHL1 | |
| Hydrochloric Acid SCHEMBL5013616 | 0.51 | MEN1 (0.43) | ALDH1A1MEN1KMT2A | |
| SCHEMBL13746373 | 0.51 | MEN1 (0.40) | MEN1KMT2AUCHL1 | |
| SCHEMBL38665343 | 0.49 | — | — | |
| SCHEMBL27606696 | 0.49 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001049288-A9 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | MERCK FROSST CANADA INC (CA) | 2001-10-25 | — | — | WO | disclosed |