Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TOP1 | P11387 | 2/20 | 0.44 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 2/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7228785 | 0.94 | KIF11 (0.52) | ADORA3S1PR1S1PR3KDM4EALDH1A1 | |
| SCHEMBL5217538 | 0.91 | S1PR1 (0.51) | ADORA3S1PR1S1PR3KIF11CASP3 | |
| SCHEMBL4619849 | 0.86 | ALDH1A1 (0.46) | ADORA3S1PR1S1PR3KDM4EALDH1A1 | |
| SCHEMBL25459772 | 0.84 | S1PR1 (0.53) | S1PR1KDM4EALDH1A1TOP1KIF11 | |
| SCHEMBL30085885 | 0.84 | S1PR1 (0.53) | S1PR1KDM4EALDH1A1TOP1KIF11 | |
| SCHEMBL2848055 | 0.84 | RAD51 (0.48) | ADORA3S1PR1S1PR3KDM4EALDH1A1 | |
| SCHEMBL4716132 | 0.83 | RAD51 (0.48) | ADORA3S1PR1S1PR3KDM4EALDH1A1 | |
| SCHEMBL1643582 | 0.83 | KDM4E (0.62) | KDM4EALDH1A1HSD17B10TOP1CASP1 | |
| SCHEMBL29894012 | 0.83 | S1PR1 (0.46) | ADORA3S1PR1S1PR3KDM4EALDH1A1 | |
| SCHEMBL8031410 | 0.83 | LMNA (0.62) | ADORA3S1PR1S1PR3RAD51KIF11 |
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-110407816-A | A kind of compound and application and device using the compound | UNIV TSINGHUA | 2019-11-05 | — | — | CN | disclosed |