Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 17/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 17/20 | 0.42 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.42 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28454445 | 0.96 | TDP1 (0.41) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28452633 | 0.92 | PIK3CA (0.39) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28450346 | 0.85 | PIK3CA (0.42) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28457879 | 0.83 | PIK3CA (0.41) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28449889 | 0.81 | PIK3CA (0.39) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28450348 | 0.81 | HTR1B (0.40) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28454600 | 0.80 | HTR1B (0.41) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL20350988 | 0.78 | HTR7 (0.42) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL29152063 | 0.77 | PIK3CA (0.49) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB | |
| SCHEMBL28457784 | 0.77 | PIK3CA (0.38) | PIK3CAHDAC1PIK3CDPIK3R1PIK3CB |
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 |
|---|---|---|---|---|---|---|---|
| CN-111646973-B | Polysubstituted quinazoline derivative and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-07-19 | — | — | CN | disclosed |
| CN-111646973-A | Polysubstituted quinazoline derivative and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-09-11 | — | — | CN | disclosed |