Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.61 |
| ▸ | RELA | Q04206 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7313251 | 0.86 | KDM4E (0.77) | LMNATP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23486325 | 0.85 | TSHR (0.76) | MAPTLMNATP53NPC1RAB9A | |
| SCHEMBL6210076 | 0.85 | MGLL (0.67) | ALOX5MAPTLMNATP53NPC1 | |
| SCHEMBL17730081 | 0.84 | ALOX5 (0.71) | ALOX5MAPTLMNATP53NPC1 | |
| SCHEMBL27979652 | 0.84 | CA12 (0.71) | ALOX5MAPTLMNATP53NPC1 | |
| SCHEMBL11837576 | 0.83 | ALOX5 (0.69) | ALOX5MAPTLMNATP53NPC1 | |
| SCHEMBL3811686 | 0.83 | ALOX5 (0.69) | ALOX5MAPTLMNATP53NPC1 | |
| SCHEMBL7298499 | 0.83 | ALDH1A1 (0.70) | MAPTLMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL77309 | 0.83 | MAPT (0.63) | ALOX5MAPTLMNATP53NPC1 | |
| SCHEMBL13595617 | 0.82 | KDM4E (0.56) | ALOX5MAPTTP53NPC1RAB9A |
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-0520336-A2 | Aldehyde derivatives and their use as calpain inhibitors | FUJIREBIO Inc. (JP) | 1992-12-30 | — | — | EP | disclosed |