Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | MAPT | P10636 | 2/20 | 0.69 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | POLB | P06746 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | ERO1A | Q96HE7 | 1/20 | 0.62 |
| ▸ | CASP3 | P42574 | 1/20 | 0.62 |
| ▸ | MITF | O75030 | 1/20 | 0.62 |
| ▸ | KDR | P35968 | 1/20 | 0.59 |
| ▸ | SNCA | P37840 | 1/20 | 0.59 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.59 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.59 |
| ▸ | CASP6 | P55212 | 1/20 | 0.59 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL7378301 | 0.91 | ALDH1A1 (0.74) | NPC1ALDH1A1MAPTABCG2MEN1 | |
| SCHEMBL8337049 | 0.89 | MEN1 (0.68) | NPC1ALDH1A1MAPTABCG2MEN1 | |
| SCHEMBL28734353 | 0.89 | NPC1 (1.00) | NPC1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL23673663 | 0.86 | NPC1 (0.73) | NPC1ALDH1A1MAPTABCG2MEN1 | |
| SCHEMBL6958604 | 0.86 | PHGDH (0.76) | NPC1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL8334964 | 0.86 | ALOX5 (0.70) | NPC1ALDH1A1MAPTABCG2MEN1 | |
| SCHEMBL16684914 | 0.84 | HDAC1 (0.73) | NPC1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL6866168 | 0.84 | NPC1 (0.71) | NPC1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL13212312 | 0.84 | NPC1 (0.71) | NPC1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL7372444 | 0.84 | NPC1 (0.71) | NPC1ALDH1A1MAPTMEN1KMT2A |
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 |