Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | NQO2 | P16083 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25811635 | 0.81 | HTR2A (0.34) | HTR2AMEN1ALDH1A1DNMT1CACNA1B | |
| SCHEMBL25811637 | 0.81 | HTR2A (0.37) | HTR2AMEN1ALDH1A1DNMT1CACNA1B | |
| SCHEMBL25824422 | 0.80 | AKR1B1 (0.37) | HTR2AALDH1A1AKR1B1 | |
| SCHEMBL25826787 | 0.79 | GABRA1 (0.40) | HTR2AMEN1ALDH1A1KMT2AAKR1B1 | |
| SCHEMBL26197128 | 0.79 | TAAR1 (0.41) | HTR2AMEN1ALDH1A1KMT2ATAAR1 | |
| SCHEMBL23409296 | 0.75 | ALDH1A1 (0.40) | MEN1ALDH1A1DNMT1CACNA1BAPBA1 | |
| SCHEMBL29903147 | 0.75 | ALDH1A1 (0.40) | MEN1ALDH1A1DNMT1CACNA1BAPBA1 | |
| SCHEMBL23053933 | 0.74 | ESR1 (0.39) | MEN1ALDH1A1DNMT1CACNA1BAPBA1 | |
| SCHEMBL9234732 | 0.73 | MEN1 (0.54) | MEN1ALDH1A1DNMT1CACNA1BAPBA1 | |
| SCHEMBL25822333 | 0.73 | HTR2A (0.32) | HTR2A |
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-2023125989-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |