Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | CDC7 | O00311 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 3/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.34 |
| ▸ | MINK1 | Q8N4C8 | 2/20 | 0.34 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.33 |
| ▸ | FEN1 | P39748 | 2/20 | 0.33 |
| ▸ | AXL | P30530 | 1/20 | 0.33 |
| ▸ | MERTK | Q12866 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12496280 | 1.00 | KCNH2 (0.38) | KCNH2CDC7HTR2AHTR2CMAPK1 | |
| SCHEMBL18936977 | 0.87 | KCNH2 (0.43) | KCNH2FYNMAP4K4MINK1TNIK | |
| SCHEMBL18936976 | 0.87 | KCNH2 (0.43) | KCNH2FYNMAP4K4MINK1TNIK | |
| SCHEMBL12496246 | 0.83 | KCNH2 (0.43) | KCNH2HTR2AHTR2CFYNMAP4K4 | |
| SCHEMBL12496244 | 0.83 | KCNH2 (0.43) | KCNH2HTR2AHTR2CFYNMAP4K4 | |
| SCHEMBL18936952 | 0.83 | KCNH2 (0.43) | KCNH2HTR2AHTR2CFYNMAP4K4 | |
| SCHEMBL12496293 | 0.77 | KCNH2 (0.43) | KCNH2MAPK1FYNMAP4K4MINK1 | |
| SCHEMBL12495782 | 0.72 | KCNH2 (0.43) | KCNH2HTR2AHTR2CFYNMAP4K4 | |
| SCHEMBL12495780 | 0.72 | KCNH2 (0.43) | KCNH2HTR2AHTR2CFYNMAP4K4 | |
| SCHEMBL18936979 | 0.71 | KCNH2 (0.46) | KCNH2HTR2AHTR2CMAPK1FYN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2681206-B1 | MST1 KINASE INHIBITORS AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS INC (US) | 2017-06-14 | — | — | EP | disclosed |
| EP-2681206-A1 | MST1 KINASE INHIBITORS AND METHODS OF THEIR USE | Lexicon Pharmaceuticals, Inc. (US) | 2014-01-08 | — | — | EP | disclosed |
| WO-2012121992-A1 | MST1 KINASE INHIBITORS AND METHODS OF THEIR USE | LEXICON PHARMACEUTICALS, INC. (US) | 2012-09-13 | — | — | WO | disclosed |