Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 4/20 | 0.33 |
| ▸ | PLA2G4A | P47712 | 4/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | TNKS | O95271 | 1/20 | 0.30 |
| ▸ | PRKDC | P78527 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22958757 | 0.98 | BACE1 (0.33) | BACE1PLA2G2APLA2G4AALOX5CASP3 | |
| SCHEMBL22958646 | 0.98 | BACE1 (0.35) | BACE1PLA2G2APLA2G4AALOX5CASP3 | |
| SCHEMBL22958733 | 0.96 | ALOX5 (0.35) | BACE1PLA2G2APLA2G4AALOX5CASP3 | |
| SCHEMBL22958732 | 0.95 | PLA2G2A (0.37) | BACE1PLA2G2APLA2G4AALOX5CASP3 | |
| SCHEMBL22958782 | 0.95 | ALOX5 (0.36) | BACE1ALOX5CASP3SENP7SENP6 | |
| SCHEMBL22958672 | 0.94 | BACE1 (0.34) | BACE1PLA2G2APLA2G4AALOX5CASP3 | |
| SCHEMBL20208646 | 0.93 | ALOX5 (0.34) | BACE1ALOX5L3MBTL1KDM4ENPC1 | |
| SCHEMBL29824930 | 0.93 | ALOX5 (0.34) | BACE1ALOX5L3MBTL1KDM4ENPC1 | |
| SCHEMBL22958703 | 0.93 | ALOX5 (0.37) | BACE1PLA2G2APLA2G4AALOX5CASP3 | |
| SCHEMBL22958774 | 0.92 | PLA2G2A (0.33) | BACE1PLA2G2APLA2G4AALOX5PLA2G10 |
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 |
|---|---|---|---|---|---|---|---|
| US-20210043852-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-02-11 | — | — | US | disclosed |