Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.50 |
| ▸ | PARP1 | P09874 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 5/20 | 0.43 |
| ▸ | CASP7 | P55210 | 2/20 | 0.43 |
| ▸ | CASP2 | P42575 | 1/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RGS12 | O14924 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL262473 | 0.88 | GSK3B (0.50) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL29378366 | 0.84 | TOP1 (0.55) | GSK3BKDM4EALDH1A1GAAHPGD | |
| SCHEMBL9768590 | 0.84 | KDM4E (0.51) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL384815 | 0.84 | TOP1 (0.55) | GSK3BKDM4EALDH1A1GAAHPGD | |
| SCHEMBL28119318 | 0.83 | KDM4E (0.51) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL9123193 | 0.81 | GSK3B (0.43) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL16754925 | 0.80 | GSK3B (0.62) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL5506330 | 0.80 | MAOA (0.51) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL4869329 | 0.80 | CA1 (0.58) | GSK3BPARP1KDM4EALDH1A1GAA | |
| SCHEMBL7399139 | 0.80 | DDB1 (0.46) | GSK3BPARP1KDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-106029052-A | Novel peracid-containing particle | 雷沃利默（英国）有限公司 | 2016-10-12 | — | — | CN | claimed |