Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.53 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.52 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.52 |
| ▸ | TDO2 | P48775 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 1/20 | 0.47 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MASP2 | O00187 | 1/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8644295 | 0.80 | PIK3CA (0.73) | EGFRPIK3CAPIK3CDTDO2FGFR4 | |
| SCHEMBL29723993 | 0.76 | EGFR (0.61) | EGFRPIK3CAPIK3CDTDO2FGFR4 | |
| SCHEMBL11712219 | 0.74 | ALDH1A1 (0.58) | PIK3CAPLAUHTR3EHTR3BHTR3A | |
| SCHEMBL28178788 | 0.74 | EGFR (0.67) | EGFRPIK3CAPIK3CDTDO2FGFR4 | |
| SCHEMBL3042419 | 0.73 | PIK3CD (0.63) | EGFRPIK3CAPIK3CDTDO2FGFR4 | |
| SCHEMBL20687402 | 0.73 | PIK3CD (0.73) | EGFRPIK3CAPIK3CDTDO2BACE1 | |
| SCHEMBL30669824 | 0.72 | PIK3CA (0.62) | EGFRPIK3CAPIK3CDTDO2ALDH1A1 | |
| SCHEMBL27892456 | 0.72 | PIK3CA (0.62) | EGFRPIK3CAPIK3CDTDO2ALDH1A1 | |
| SCHEMBL16848368 | 0.72 | ALDH1A1 (0.46) | PIK3CAPIK3CDPLAUHTR3EHTR3B | |
| SCHEMBL989969 | 0.72 | ASIC3 (0.51) | PLAUHTR3EHTR3BHTR3ABACE1 |
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-118344355-A | Quinazolinone derivative, preparation method thereof and application thereof in anti-inflammatory and anti-tumor | 贵州省天然产物研究中心 | 2024-07-16 | — | — | CN | disclosed |
| CN-116253686-B | Aminobenzimidazole benzamide derivative and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2023-11-17 | — | — | CN | disclosed |
| CN-116253686-A | Aminobenzimidazole benzamide derivative and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2023-06-13 | — | — | CN | disclosed |
| CN-110655505-B | 6- (2-amino-1H-benzo [ d ] imidazol-6-yl) quinazolin-4 (3H) -ones | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2022-06-21 | — | — | CN | disclosed |