Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 6/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | IKBKB | O14920 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8337049 | 0.91 | MEN1 (0.68) | ALOX5MEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL8334964 | 0.89 | ALOX5 (0.70) | ALOX5MEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL8335663 | 0.85 | NPC1 (0.71) | MEN1KMT2ANPC1RAB9ADEGS1 | |
| SCHEMBL11627129 | 0.80 | PHGDH (0.66) | MEN1KMT2AALDH1A1NPC1RAB9A | |
| SCHEMBL8337442 | 0.80 | NPC1 (0.80) | MEN1KMT2AALDH1A1NPC1RAB9A | |
| SCHEMBL7875424 | 0.77 | ALOX5 (0.68) | ALOX5MEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL20541898 | 0.77 | NPC1 (0.64) | MEN1KMT2AALDH1A1NPC1RAB9A | |
| SCHEMBL7787033 | 0.77 | KMT2A (0.72) | MEN1KMT2ANPC1RAB9AIKBKB | |
| SCHEMBL17915382 | 0.76 | NPC1 (0.59) | MEN1KMT2ANPC1RAB9ADEGS1 | |
| SCHEMBL6864203 | 0.76 | ALOX5 (0.67) | ALOX5MEN1KMT2AALDH1A1NPC1 |
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-2004101494-A1 | CALPAIN INHIBITORS | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (ES) | 2004-11-25 | — | — | WO | disclosed |