Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8028132 | 1.00 | ALDH1A1 (0.38) | ALDH1A1LMNAMEN1KMT2ANPSR1 | |
| SCHEMBL30361273 | 0.81 | HSP90AA1 (0.41) | ALDH1A1LMNAMEN1KMT2ANPSR1 | |
| SCHEMBL7956639 | 0.81 | HSP90AA1 (0.41) | ALDH1A1LMNAMEN1KMT2ANPSR1 | |
| SCHEMBL26981773 | 0.79 | HSP90AA1 (0.51) | ALDH1A1LMNANPSR1L3MBTL1HSP90AA1 | |
| SCHEMBL2916438 | 0.78 | HSP90AA1 (0.40) | ALDH1A1LMNANPSR1L3MBTL1HSP90AA1 | |
| SCHEMBL2916434 | 0.78 | HSP90AA1 (0.40) | ALDH1A1LMNANPSR1L3MBTL1HSP90AA1 | |
| SCHEMBL9936759 | 0.76 | HSP90AA1 (0.56) | ALDH1A1LMNANPSR1L3MBTL1HSP90AA1 | |
| SCHEMBL9936762 | 0.76 | HSP90AA1 (0.56) | ALDH1A1LMNANPSR1L3MBTL1HSP90AA1 | |
| SCHEMBL7467821 | 0.75 | HSP90AA1 (0.62) | ALDH1A1NPSR1L3MBTL1HSP90AA1SMN1; SMN2 | |
| SCHEMBL7467824 | 0.75 | HSP90AA1 (0.62) | ALDH1A1NPSR1L3MBTL1HSP90AA1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127372-A | FOR TREATMENT OR PREVENTION OF VIRAL DISEASES, ESPECIALLY AIDS OR HIV | VERTEX PHARMACEUTICALS, INCORPORATED (US) | 2000-10-03 | — | — | US | disclosed |
| EP-0749421-B1 | SULPHONAMIDE DERIVATIVES AS ASPARTYL PROTEASE INHIBITORS | VERTEX PHARMA (US) | 1999-09-15 | — | — | EP | disclosed |
| EP-0749421-A1 | SULPHONAMIDE DERIVATIVES AS ASPARTYL PROTEASE INHIBITORS | Vertex Pharmaceuticals Incorporated (US) | 1996-12-27 | — | — | EP | disclosed |
| WO-1995024385-A1 | SULPHONAMIDE DERIVATIVES AS ASPARTYL PROTEASE INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 1995-09-14 | — | — | WO | disclosed |