Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.58 |
| ▸ | BTK | Q06187 | 2/20 | 0.53 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.51 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29002882 | 1.00 | MEN1 (0.61) | MEN1KMT2APIK3CDBTKGPR119 | |
| SCHEMBL12276928 | 0.95 | MEN1 (0.64) | MEN1KMT2APIK3CDBTKGPR119 | |
| SCHEMBL15264726 | 0.85 | MEN1 (0.51) | MEN1KMT2APIK3CDCNR1CNR2 | |
| SCHEMBL16748171 | 0.83 | PIK3CD (0.46) | MEN1KMT2APIK3CDBTKCNR1 | |
| SCHEMBL28895304 | 0.82 | PIK3CD (0.66) | PIK3CDBTKGPR119ADORA1CNR1 | |
| SCHEMBL15265266 | 0.80 | MEN1 (0.52) | MEN1KMT2ACNR1CNR2MAP4K4 | |
| SCHEMBL16748170 | 0.80 | MEN1 (0.45) | MEN1KMT2APIK3CDBTKGPR119 | |
| SCHEMBL14978589 | 0.80 | MEN1 (0.48) | MEN1KMT2APIK3CDGPR119CNR1 | |
| SCHEMBL796000 | 0.80 | MEN1 (0.48) | MEN1KMT2APIK3CDGPR119CNR1 | |
| SCHEMBL28048039 | 0.80 | PIK3CD (0.71) | PIK3CDBTKGPR119PIK3CAIRAK4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115894451-B | Selenium-containing PI3K delta inhibitor and application thereof in diseases caused by PI3K delta overexpression and medicines | 西安爱思益生物科技有限公司 | 2024-07-09 | — | — | CN | disclosed |
| CN-114315826-B | Pyridopyrimidine compound and application thereof | 西安交通大学 | 2023-05-16 | — | — | CN | disclosed |
| CN-115894451-A | Selenium-containing PI3K delta inhibitor, application thereof in diseases caused by PI3K delta overexpression and medicine | 西安爱思益生物科技有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-114315826-A | Pyridopyrimidine compound and application thereof | 西安交通大学 | 2022-04-12 | — | — | CN | disclosed |