Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16721031 | 0.83 | CYP2C19 (0.44) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL453396 | 0.77 | TAAR1 (0.52) | KIF11CYP2C19CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL27684720 | 0.76 | KIF11 (0.43) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL10804024 | 0.76 | CYP1A2 (0.41) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL25710684 | 0.76 | HSD17B10 (0.65) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL2355481 | 0.76 | CYP1A2 (0.59) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| Hydrochloric Acid SCHEMBL10684188 | 0.75 | SMN1; SMN2 (0.50) | KIF11CYP2C19CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL27684804 | 0.73 | KIF11 (0.41) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL7217419 | 0.73 | KIF11 (0.41) | KIF11HPGDHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL145926 | 0.73 | KCNH2 (0.38) | KIF11HPGDHSD17B10CYP2C19CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0650368-A1 | USE OF CALPAIN INHIBITORS IN THE INHIBITION AND TREATMENT OF MEDICAL CONDITIONS ASSOCIATED WITH INCREASED CALPAIN ACTIVITY | CORTEX PHARMACEUTICALS, INC. (US) | 1995-05-03 | — | — | EP | disclosed |
| WO-1994000095-A2 | USE OF CALPAIN INHIBITORS IN THE INHIBITION AND TREATMENT OF MEDICAL CONDITIONS ASSOCIATED WITH INCREASED CALPAIN ACTIVITY | CORTEX PHARMACEUTICALS, INC. (US) | 1994-01-06 | — | — | WO | disclosed |