Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 14/20 | 0.77 |
| ▸ | RAB9A | P51151 | 13/20 | 0.77 |
| ▸ | MAOA | P21397 | 1/20 | 0.65 |
| ▸ | BLVRB | P30043 | 1/20 | 0.65 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.52 |
| ▸ | RELA | Q04206 | 4/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL60513 | 1.00 | NPC1 (0.77) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL30153302 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL29606585 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL59588 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL60719 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL60583 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL29607605 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL60102 | 0.97 | NPC1 (0.72) | NPC1RAB9AMAOABLVRBHDAC6 | |
| Ethane SCHEMBL25325513 | 0.96 | NPC1 (0.71) | NPC1RAB9AMAOABLVRBHDAC6 | |
| SCHEMBL12172093 | 0.89 | NPC1 (0.69) | NPC1RAB9AMAOABLVRBHDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3889142-B1 | 1,2,4-OXADIAZOLE BENZOIC ACID COMPOUNDS AND THEIR USE FOR NONSENSE SUPPRESSION AND THE TREATMENT OF DISEASE | PTC THERAPEUTICS INC (US) | 2022-06-15 | — | — | EP | disclosed |