Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 13/20 | 0.61 |
| ▸ | CASP5 | P51878 | 13/20 | 0.61 |
| ▸ | CASP4 | P49662 | 11/20 | 0.61 |
| ▸ | GBA1 | P04062 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9755196 | 0.92 | CASP1 (0.59) | CASP1CASP5CASP4GBA1MEN1 | |
| SCHEMBL9640124 | 0.85 | CASP1 (0.59) | CASP1CASP5CASP4GBA1 | |
| Butyric Acid SCHEMBL9640502 | 0.84 | CASP1 (0.52) | CASP1CASP5CASP4GBA1MEN1 | |
| SCHEMBL9755201 | 0.82 | MEN1 (0.73) | CASP1CASP5CASP4GBA1MEN1 | |
| Hydrochloric Acid SCHEMBL9639434 | 0.81 | KMT2A (0.71) | CASP1CASP5CASP4GBA1MEN1 | |
| SCHEMBL9755198 | 0.79 | CASP1 (0.60) | CASP1CASP5CASP4GBA1MEN1 | |
| Fumaric Acid SCHEMBL9755183 | 0.79 | CASP1 (0.54) | CASP1CASP5CASP4GBA1MEN1 | |
| Fumaric Acid SCHEMBL9755181 | 0.79 | CASP1 (0.54) | CASP1CASP5CASP4GBA1MEN1 | |
| SCHEMBL9639649 | 0.79 | CASP1 (0.53) | CASP1CASP5CASP4GBA1MEN1 | |
| SCHEMBL9690061 | 0.78 | CASP1 (0.51) | CASP1CASP5CASP4GBA1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991006542-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1991-05-16 | — | — | WO | disclosed |