Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 2/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.32 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.32 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.31 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24461254 | 0.88 | GBA1 (0.40) | GPR119GBA1 | |
| SCHEMBL23205833 | 0.84 | ALDH1A1 (0.39) | GBA1KDM1APGRLTA4HALDH1A1 | |
| SCHEMBL12563475 | 0.81 | ALDH1A1 (0.35) | GPR119GBA1KDM1ALTA4HALDH1A1 | |
| SCHEMBL21743155 | 0.81 | CHRM3 (0.38) | MEN1MAPK1KMT2AKCNA3SMN1; SMN2 | |
| SCHEMBL21667895 | 0.81 | CHRM3 (0.38) | MEN1MAPK1KMT2AKCNA3SMN1; SMN2 | |
| SCHEMBL17212848 | 0.81 | CHRM3 (0.38) | MEN1MAPK1KMT2AKCNA3SMN1; SMN2 | |
| SCHEMBL12458880 | 0.79 | GBA1 (0.38) | GBA1KDM1ALTA4HALDH1A1MEN1 | |
| SCHEMBL18082565 | 0.79 | GBA1 (0.38) | GBA1KDM1ALTA4HALDH1A1MEN1 | |
| SCHEMBL21667904 | 0.78 | NCF1 (0.40) | — | |
| SCHEMBL20715147 | 0.78 | NCF1 (0.40) | — |
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-2021031952-A1 | OXYGEN-SUBSTITUTED SIX-MEMBERED RING PYRIMIDINE COMPOUND, PREPARATION METHOD AND MEDICAL USE THEREOF | 劲方医药科技(上海)有限公司 | 2021-02-25 | — | — | WO | disclosed |