Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.64 |
| ▸ | GSK3A | P49840 | 6/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | ATR | Q13535 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Tert-Butylamine SCHEMBL28092366 | 0.94 | GSK3B (0.58) | GSK3BGSK3AMAPTATRNPC1 | |
| SCHEMBL20189799 | 0.83 | GSK3B (0.71) | GSK3BGSK3AMAPTATR | |
| SCHEMBL20205171 | 0.81 | GSK3B (0.76) | GSK3BGSK3AMAPTATR | |
| SCHEMBL16702397 | 0.80 | GSK3B (0.68) | GSK3BGSK3AMAPTATR | |
| SCHEMBL20205114 | 0.80 | GSK3B (0.75) | GSK3BGSK3AMAPTATR | |
| SCHEMBL20189134 | 0.79 | GSK3B (0.74) | GSK3BGSK3AMAPTATR | |
| SCHEMBL20205091 | 0.78 | GSK3B (0.72) | GSK3BGSK3AMAPTATR | |
| SCHEMBL20205038 | 0.78 | GSK3A (1.00) | GSK3BGSK3A | |
| SCHEMBL20205026 | 0.78 | GSK3B (0.79) | GSK3BGSK3AMAPT | |
| SCHEMBL20189392 | 0.78 | GSK3A (0.85) | GSK3BGSK3AMAPT |
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-105849098-A | Gsk-3 inhibitors | 百时美施贵宝公司 | 2016-08-10 | — | — | CN | disclosed |