Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7299332 | 0.84 | KMT2A (0.44) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7303381 | 0.81 | KMT2A (0.54) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL30753717 | 0.80 | SMN1; SMN2 (0.50) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL7302037 | 0.78 | KMT2A (0.42) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL10957176 | 0.78 | CYP1A2 (0.63) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL10730101 | 0.77 | SMN1; SMN2 (0.49) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL11572335 | 0.77 | CYP1A2 (0.61) | KMT2AMEN1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL576685 | 0.75 | SMN1; SMN2 (0.56) | KMT2AMEN1SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL29722952 | 0.75 | SMN1; SMN2 (0.56) | KMT2AMEN1SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL7305059 | 0.73 | SMN1; SMN2 (0.42) | KMT2AMEN1SMN1; SMN2ALDH1A1HPGD |
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 |