Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 12/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 2/20 | 0.41 |
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6184273 | 0.87 | CTSB (0.49) | MAPK1SMN1; SMN2ALDH1A1GPR119LMNA | |
| SCHEMBL7588285 | 0.82 | MAPT (0.45) | MAPK1SMN1; SMN2ALDH1A1GPR119LMNA | |
| SCHEMBL1473079 | 0.77 | MAPT (0.58) | MAPK1SMN1; SMN2ALDH1A1LMNAMAPT | |
| SCHEMBL7042069 | 0.76 | CTSB (0.51) | MAPK1SMN1; SMN2ALDH1A1LMNAMAPT | |
| SCHEMBL6182683 | 0.76 | GPR119 (0.45) | GPR119 | |
| SCHEMBL6183250 | 0.75 | MAPT (0.44) | MAPK1SMN1; SMN2ALDH1A1GPR119LMNA | |
| SCHEMBL6183679 | 0.74 | GPR119 (0.43) | GPR119CTSBCTSSCTSLCTSK | |
| SCHEMBL3767565 | 0.74 | MAPT (0.74) | MAPK1SMN1; SMN2ALDH1A1LMNAMAPT | |
| SCHEMBL29157428 | 0.74 | MAPT (0.74) | MAPK1SMN1; SMN2ALDH1A1LMNAMAPT | |
| SCHEMBL13208949 | 0.74 | MAPT (0.58) | MAPK1SMN1; SMN2ALDH1A1GPR119LMNA |
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 | claimed |