Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25811567 | 0.79 | CYP3A4 (0.38) | ALOX15NR1I2LMNAAKT1 | |
| SCHEMBL25819251 | 0.76 | AKT1 (0.35) | AKT1 | |
| SCHEMBL4462887 | 0.74 | AKT1 (0.44) | ALDH1A1ALOX15NR1I2LMNACYP2C9 | |
| SCHEMBL29862066 | 0.74 | ALOX5 (0.33) | AKT1 | |
| SCHEMBL25811610 | 0.72 | NR1I2 (0.32) | ALDH1A1ALOX15NR1I2LMNACYP2C9 | |
| SCHEMBL31461881 | 0.71 | PTGS2 (0.40) | ALDH1A1ALOX15LMNAAKT1KDM4E | |
| SCHEMBL25811620 | 0.69 | MEN1 (0.33) | ALDH1A1ALOX15NR1I2LMNACYP2C9 | |
| SCHEMBL24755126 | 0.69 | CYP3A4 (0.38) | ALOX15NR1I2LMNAAKT1 | |
| SCHEMBL27300608 | 0.69 | FDPS (0.35) | ALDH1A1CYP2C9HSD17B10KDM4EMAPT | |
| SCHEMBL19296761 | 0.68 | ALDH1A1 (0.39) | ALDH1A1ALOX15NR1I2LMNACYP2C9 |
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 |