Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 11/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 9/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.52 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7433934 | 1.00 | MAPT (0.58) | MAPTADORA3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL6185021 | 0.88 | MEN1 (0.52) | MAPTADORA3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL6181829 | 0.82 | MEN1 (0.52) | MAPTADORA3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL6180437 | 0.81 | ROCK2 (0.50) | MAPTMEN1KMT2ASMN1; SMN2HTT | |
| SCHEMBL7439002 | 0.79 | ROCK2 (0.50) | MAPTMEN1KMT2ASMN1; SMN2HTT | |
| SCHEMBL8823169 | 0.75 | MAPT (1.00) | MAPTADORA3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5869395 | 0.72 | MEN1 (0.60) | MAPTMEN1KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL5869382 | 0.72 | MEN1 (0.60) | MAPTMEN1KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL6180116 | 0.72 | CTSK (0.56) | MEN1KMT2A | |
| SCHEMBL5869368 | 0.72 | MEN1 (0.60) | MAPTMEN1KMT2ASMN1; SMN2NPC1 |
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-2001068645-A2 | N-CYANOMETHYLCARBOXAMIDES AND THEIR USE AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-09-20 | — | — | WO | disclosed |