Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | CASP9 | P55211 | 1/20 | 0.48 |
| ▸ | CASP6 | P55212 | 1/20 | 0.48 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KLK7 | P49862 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7297799 | 1.00 | CASP3 (0.48) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL11802080 | 0.84 | RAB9A (0.48) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL4652104 | 0.84 | CASP3 (0.55) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL7308499 | 0.84 | CASP3 (0.55) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL9398872 | 0.84 | TSHR (0.52) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL3834292 | 0.84 | TSHR (0.52) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL3834296 | 0.84 | TSHR (0.52) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL10639437 | 0.81 | RAB9A (0.50) | CASP3CASP7CASP9CASP6CASP8 | |
| SCHEMBL7305671 | 0.80 | KDM4E (0.59) | MEN1KMT2ACYP2C9CYP2C19RAB9A | |
| SCHEMBL7306271 | 0.80 | KDM4E (0.59) | MEN1KMT2ACYP2C9CYP2C19RAB9A |
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 |