Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 4/20 | 0.38 |
| ▸ | PLA2G4A | P47712 | 4/20 | 0.38 |
| ▸ | TNKS | O95271 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19683308 | 0.91 | CYP1A1 (0.36) | ABCG2PAX8CYP1A1CYP1A2FYN | |
| SCHEMBL19683305 | 0.83 | PAX8 (0.41) | ABCG2PAX8CYP1A1CYP1A2FYN | |
| SCHEMBL20209465 | 0.82 | ALOX5 (0.51) | NPC1RAB9AAPAF1USP2L3MBTL1 | |
| SCHEMBL20208694 | 0.79 | ALOX5 (0.41) | ABCG2PAX8CYP1A1CYP1A2FYN | |
| SCHEMBL19543762 | 0.79 | PGR (0.45) | PLA2G2APLA2G4ATDP1PLA2G10L3MBTL1 | |
| SCHEMBL19683316 | 0.78 | CYP26B1 (0.36) | ABCG2PAX8CYP1A1CYP1A2FYN | |
| SCHEMBL19683432 | 0.78 | CYP26B1 (0.41) | ABCG2CYP1A1CYP1A2PLA2G2APLA2G4A | |
| SCHEMBL19683536 | 0.78 | PLA2G2A (0.49) | ABCG2PLA2G2APLA2G4ATNKSNPC1 | |
| SCHEMBL19683563 | 0.78 | ABCG2 (0.47) | ABCG2PAX8CYP1A1CYP1A2FYN | |
| SCHEMBL23660712 | 0.78 | MAPT (0.41) | CYP1A2AHRPLA2G2APLA2G4ATNKS |
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 |