Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 2/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7311685 | 0.98 | ALDH1A1 (0.41) | ALDH1A1TSHRHTTLMNAGAA | |
| SCHEMBL19864371 | 0.77 | KIF11 (0.44) | ALDH1A1 | |
| SCHEMBL7303082 | 0.76 | METAP2 (0.60) | ALDH1A1TSHRHTTLMNAMETAP2 | |
| SCHEMBL3448883 | 0.75 | KIF11 (0.47) | ALDH1A1SLC2A1 | |
| SCHEMBL7609411 | 0.75 | KIF11 (0.47) | ALDH1A1SLC2A1 | |
| Hydrochloric Acid SCHEMBL7308386 | 0.75 | METAP2 (0.59) | ALDH1A1LMNAMETAP2NPSR1 | |
| SCHEMBL110806 | 0.74 | ALOX15 (0.42) | ALDH1A1TSHRHTTLMNAGAA | |
| SCHEMBL112490 | 0.74 | ALOX15 (0.42) | ALDH1A1TSHRHTTLMNAGAA | |
| SCHEMBL110807 | 0.74 | ALOX15 (0.42) | ALDH1A1TSHRHTTLMNAGAA | |
| SCHEMBL11739657 | 0.74 | ALOX15 (0.42) | ALDH1A1TSHRHTTLMNAGAA |
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 |