Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR183 | P32249 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22242835 | 0.74 | MAOA (0.40) | MAOASHMT2NPC1ALDH1A1TRPV1 | |
| SCHEMBL21593836 | 0.72 | NPC1 (0.42) | GPR183MAOANPC1ALDH1A1TRPV1 | |
| SCHEMBL14614802 | 0.69 | PDE3B (0.46) | MAOANPC1ALDH1A1TRPV1GAA | |
| SCHEMBL7473916 | 0.69 | MAOA (0.44) | GPR183MAOANPC1ALDH1A1TRPV1 | |
| SCHEMBL20455684 | 0.69 | PDE3B (0.41) | GPR183MAOANPC1ALDH1A1TRPV1 | |
| SCHEMBL20702882 | 0.68 | HPGD (0.45) | MAOANPC1ALDH1A1LMNAMEN1 | |
| SCHEMBL20702884 | 0.68 | HPGD (0.45) | MAOANPC1ALDH1A1LMNAMEN1 | |
| SCHEMBL20702982 | 0.67 | ALDH1A1 (0.54) | MAOANPC1ALDH1A1LMNAMAPT | |
| SCHEMBL20455676 | 0.67 | ALDH1A1 (0.43) | NPC1ALDH1A1GAALMNAMEN1 | |
| SCHEMBL20467962 | 0.66 | NPC1 (0.54) | MAOASHMT2NPC1ALDH1A1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110831599-B | Compounds, compositions and methods for cancer treatment | 布罗德研究所股份有限公司 | 2023-03-28 | — | — | CN | disclosed |
| CN-110831599-A | Compounds, compositions and methods for cancer treatment | 布罗德研究所股份有限公司 | 2020-02-21 | — | — | CN | disclosed |