Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | GBA2 | Q9HCG7 | 8/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27459516 | 0.83 | GBA1 (0.35) | GBA1MAPTHTTLMNANPSR1 | |
| SCHEMBL27616126 | 0.81 | GBA1 (0.33) | GBA1MAPTHTTLMNANPSR1 | |
| SCHEMBL17931101 | 0.78 | GBA1 (0.37) | GBA1MAPTHTTMEN1KMT2A | |
| SCHEMBL17931186 | 0.77 | GAA (0.33) | — | |
| SCHEMBL2784563 | 0.77 | LMNA (0.37) | GBA1MAPTHTTLMNANPSR1 | |
| SCHEMBL17931173 | 0.77 | GAA (0.44) | — | |
| SCHEMBL3161047 | 0.76 | NAAA (0.41) | MAPTHTTLMNANPSR1MEN1 | |
| SCHEMBL671959 | 0.73 | LMNA (0.33) | MAPTHTTLMNANPSR1MEN1 | |
| SCHEMBL6269708 | 0.73 | PPARG (0.39) | MEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL23355236 | 0.71 | GBA1 (0.42) | GBA1MAPTHTTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3820846-A1 | COMPOSITION FOR INHIBITING MONOMER POLYMERIZATION COMPRISING A NITROXIDE INHIBITOR, A QUINONE METHIDE RETARDER AND AN AMINE STABILIZER | Ecolab USA, Inc. (US) | 2021-05-19 | — | — | EP | disclosed |