Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 7/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.32 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL495104 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL494177 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL495091 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL494363 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL495362 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL14620255 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL494260 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL495600 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL496368 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 | |
| SCHEMBL495217 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRTP53CA2MAPK1 |
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-0232089-B1 | QUINONE AMIDES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1991-03-13 | — | — | EP | disclosed |
| EP-0232089-A2 | Quinone amides, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1987-08-12 | — | — | EP | disclosed |