Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | ANO1 | Q5XXA6 | 3/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19683351 | 0.99 | PGR (0.35) | PGRESR1ESR2ANO1PLA2G2A | |
| SCHEMBL31672326 | 0.87 | TNK2 (0.40) | PLA2G2APLA2G4AABCG2MEN1KMT2A | |
| SCHEMBL19683359 | 0.87 | TNK2 (0.40) | PLA2G2APLA2G4AABCG2MEN1KMT2A | |
| SCHEMBL19683444 | 0.87 | TNK2 (0.40) | PLA2G2APLA2G4AABCG2MEN1KMT2A | |
| SCHEMBL26824296 | 0.81 | L3MBTL1 (0.41) | ANO1PLA2G2APLA2G4AMEN1KMT2A | |
| SCHEMBL26827669 | 0.80 | ANO1 (0.40) | PGRANO1PLA2G2APLA2G4AMEN1 | |
| SCHEMBL26827841 | 0.80 | ANO1 (0.40) | PGRANO1PLA2G2APLA2G4AMEN1 | |
| SCHEMBL17190933 | 0.80 | PLA2G2A (0.35) | PGRESR1ESR2ANO1PLA2G2A | |
| SCHEMBL15852378 | 0.80 | PGR (0.40) | PGRESR1ESR2PLA2G2APLA2G4A | |
| SCHEMBL26827631 | 0.80 | ANO1 (0.41) | PGRESR1ESR2ANO1PLA2G2A |
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-2017210072-A1 | ELECTROACTIVE COMPOUNDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2017-12-07 | — | — | WO | disclosed |