Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SMO | Q99835 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28604242 | 0.91 | L3MBTL1 (0.53) | GBA1ALDH1A1HPGDMAPTPIK3CD | |
| SCHEMBL477324 | 0.79 | HSD17B10 (0.44) | GBA1HSD17B10ALDH1A1HPGDMAPT | |
| SCHEMBL15879042 | 0.77 | MEN1 (0.50) | ALDH1A1MAPTPIK3CAMEN1KMT2A | |
| SCHEMBL14387482 | 0.77 | MEN1 (0.50) | ALDH1A1MAPTPIK3CAMEN1KMT2A | |
| SCHEMBL21192964 | 0.77 | GBA1 (0.66) | GBA1HSD17B10SMOALDH1A1HPGD | |
| SCHEMBL13034553 | 0.76 | GBA1 (0.75) | GBA1HSD17B10ALDH1A1HPGDMAPT | |
| SCHEMBL6801706 | 0.76 | NCF1 (0.53) | GBA1HSD17B10SMOMAPTTP53 | |
| SCHEMBL5988143 | 0.75 | GBA1 (0.56) | GBA1ALDH1A1MAPTCASP6GFER | |
| SCHEMBL26604148 | 0.75 | GBA1 (0.52) | GBA1SMOMAPTTP53CASP6 | |
| SCHEMBL15557358 | 0.75 | HTT (0.51) | HSD17B10ALDH1A1HPGDMAPTPIK3CA |
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-2022242321-A1 | PI3Kα SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 中国药科大学 | 2022-11-24 | — | — | WO | disclosed |