Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPN1 | P15169 | 2/20 | 0.42 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.42 |
| ▸ | PTGFR | P43088 | 1/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28040963 | 0.89 | L3MBTL1 (0.40) | CTSAALDH1A1IDO1TDO2GAA | |
| SCHEMBL13250508 | 0.81 | CYP2C19 (0.52) | CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL28243237 | 0.81 | AKR1C3 (0.47) | ALDH1A1MEN1KMT2AAKR1C3AKR1C2 | |
| SCHEMBL5021484 | 0.80 | CPN1 (0.46) | CPN1CPB2PTGFRCTSAALDH1A1 | |
| SCHEMBL21808436 | 0.79 | AKR1C3 (0.49) | CPN1CPB2CTSAALDH1A1GAA | |
| SCHEMBL288665 | 0.79 | AKR1C3 (0.49) | CPN1CPB2CTSAALDH1A1GAA | |
| SCHEMBL27996917 | 0.79 | CPN1 (0.49) | CPN1CPB2CTSAALDH1A1MEN1 | |
| SCHEMBL6298061 | 0.76 | ALDH1A1 (0.46) | CPN1CPB2CTSAALDH1A1MEN1 | |
| SCHEMBL18343766 | 0.76 | CYP2C19 (0.47) | CPN1CPB2PTGFRCTSAALDH1A1 | |
| SCHEMBL1492705 | 0.76 | CTSK (0.46) | CPN1CPB2CTSAALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115611883-A | PI3K alpha inhibitor with bicyclic structure and preparation method and application thereof | 生物岛实验室 | 2023-01-17 | — | — | CN | disclosed |