Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7308815 | 0.92 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2HPGDMAPTTDP1 | |
| SCHEMBL8681379 | 0.91 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2HPGDMAPTTDP1 | |
| SCHEMBL7308007 | 0.88 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2HPGDMAPTMAPK1 | |
| SCHEMBL7313668 | 0.88 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2HPGDMAPTMAPK1 | |
| SCHEMBL7311572 | 0.88 | MAPK1 (0.40) | ALDH1A1SMN1; SMN2MAPTMAPK1MEN1 | |
| SCHEMBL7433847 | 0.87 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2HPGDMAPTHSD17B10 | |
| SCHEMBL8886890 | 0.85 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2HPGDMAPTHSD17B10 | |
| SCHEMBL7303801 | 0.84 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2HPGDMAPTTDP1 | |
| SCHEMBL7299096 | 0.83 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2HPGDMAPTTDP1 | |
| SCHEMBL7301797 | 0.83 | CTSK (0.42) | ALDH1A1SMN1; SMN2HPGDMAPTHSD17B10 |
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 4 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 |
| EP-0525420-A1 | Pseudopeptides and dipeptides characterised by a substituted methyl ketone moiety at the C-terminus as thiol protease inhibitors | Mitsubishi Chemical Corporation (JP) | 1993-02-03 | — | — | EP | disclosed |