Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27641543 | 0.80 | TSHR (0.52) | HTTL3MBTL1POLBKMT2ATSHR | |
| SCHEMBL28197933 | 0.80 | TSHR (0.52) | HTTL3MBTL1POLBKMT2ATSHR | |
| SCHEMBL26712 | 0.80 | TSHR (0.52) | HTTL3MBTL1POLBKMT2ATSHR | |
| SCHEMBL2834288 | 0.80 | KMT2A (0.45) | HTTL3MBTL1POLBKMT2ATSHR | |
| Benzophenone SCHEMBL28320289 | 0.75 | ALDH1A1 (0.56) | HTTL3MBTL1NPSR1KMT2ATSHR | |
| SCHEMBL7585362 | 0.75 | SMN1; SMN2 (0.50) | L3MBTL1POLBNPSR1KMT2ATSHR | |
| SCHEMBL7995250 | 0.74 | SMN1; SMN2 (0.53) | HTTL3MBTL1ALDH1A1MAPTLMNA | |
| SCHEMBL10942359 | 0.74 | ALDH1A1 (0.54) | HTTL3MBTL1NPSR1KMT2ATSHR | |
| SCHEMBL16641679 | 0.73 | PGR (0.47) | HTTL3MBTL1POLBNPSR1KMT2A | |
| SCHEMBL18153438 | 0.71 | CYP3A4 (0.45) | HTTL3MBTL1POLBKMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2598483-A1 | AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME | Rigel Pharmaceuticals, Inc. (US) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012016217-A1 | AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME | RIGEL PHARMACEUTICALS, INC. (US) | 2012-02-02 | — | — | WO | disclosed |