Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | GGT1 | P19440 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7301637 | 0.85 | ALDH1A1 (0.44) | SMN1; SMN2NPC1RAB9AALOX5ALDH1A1 | |
| SCHEMBL7303790 | 0.78 | ALDH1A1 (0.44) | SMN1; SMN2NPC1RAB9AHDAC8ALDH1A1 | |
| SCHEMBL7311207 | 0.77 | ALDH1A1 (0.45) | SMN1; SMN2NPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL7302476 | 0.76 | MAPT (0.44) | SMN1; SMN2NPC1RAB9AALDH1A1KMT2A | |
| SCHEMBL7435291 | 0.73 | CTSL (0.50) | ALDH1A1POLB | |
| SCHEMBL7435315 | 0.73 | CTSL (0.50) | ALDH1A1POLB | |
| SCHEMBL7309575 | 0.71 | ALDH1A1 (0.41) | SMN1; SMN2ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL7307305 | 0.70 | MAPT (0.36) | SMN1; SMN2ALDH1A1POLB | |
| SCHEMBL7313893 | 0.70 | MAPT (0.36) | SMN1; SMN2ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL7302949 | 0.70 | POLB (0.43) | HDAC8MEN1KMT2APOLBPTPN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0525420-B1 | Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors | MITSUBISHI CHEM CORP (JP) | 1999-05-12 | — | — | EP | disclosed |
| US-5834508-A | PROTEASE ENZYME INHIBITORS; MUSCLE DISORDERS | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-11-10 | — | — | US | disclosed |
| US-5639783-A | POTENT PROTEASE INHIBITOR FOR TREATING MUSCULAR, NERVOUS SYSTEM DISEASES | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-06-17 | — | — | US | disclosed |