Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | LIPC | P11150 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3650216 | 0.90 | POLB (0.36) | DHODHROCK2DYRK1AMAPK14 | |
| SCHEMBL3655560 | 0.89 | DHODH (0.34) | DHODHROCK2DYRK1AMAPK14 | |
| SCHEMBL3804237 | 0.85 | DYRK1A (0.33) | DHODHAKR1C3AKR1C2DYRK1ALIPC | |
| SCHEMBL4123415 | 0.81 | MAPK14 (0.34) | DHODHROCK2DYRK1ALIPCLIPG | |
| SCHEMBL4123409 | 0.81 | DHODH (0.34) | DHODHROCK2LIPCLIPGPTGDR2 | |
| SCHEMBL3653706 | 0.80 | DHODH (0.32) | DHODHROCK2PTGDR2 | |
| SCHEMBL3652261 | 0.79 | DHODH (0.35) | DHODHROCK2DYRK1ALIPCLIPG | |
| SCHEMBL3651371 | 0.79 | CTSA (0.33) | — | |
| SCHEMBL3650614 | 0.78 | CTSA (0.34) | — | |
| SCHEMBL3652596 | 0.78 | CACNA1G (0.34) | ROCK2 |
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-2190822-A2 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2010-06-02 | — | — | EP | disclosed |
| WO-2009041705-A9 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2009-08-13 | — | — | WO | disclosed |
| WO-2009041705-A2 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-04-02 | — | — | WO | disclosed |