Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TYMP | P19971 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 7/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CDA | P32320 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17901983 | 0.72 | ALDH1A1 (0.35) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL17902016 | 0.71 | ALDH1A1 (0.34) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL31207652 | 0.68 | MEN1 (0.45) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL24603324 | 0.65 | MEN1 (0.44) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL2521564 | 0.65 | MEN1 (0.44) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL3069788 | 0.65 | ALDH1A1 (0.40) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL1069501 | 0.64 | HSD11B1 (0.40) | MEN1KMT2AL3MBTL1TYMPALDH1A1 | |
| SCHEMBL360466 | 0.62 | HSD11B1 (0.49) | ALDH1A1HSD11B1LMNAGAA | |
| SCHEMBL3080507 | 0.61 | HTR6 (0.41) | MEN1MAPTKMT2ABRCA1ATM | |
| SCHEMBL3087078 | 0.61 | HTR6 (0.41) | MEN1MAPTKMT2ABRCA1ATM |
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-2021071832-A1 | ARYL HETEROBICYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS | D.E. SHAW RESEARCH, LLC (US) | 2021-04-15 | — | — | WO | disclosed |