Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | DHODH | Q02127 | 4/20 | 0.32 |
| ▸ | LIPG | Q9Y5X9 | 3/20 | 0.31 |
| ▸ | LIPC | P11150 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | WNT1 | P04628 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | ABL1 | P00519 | 1/20 | 0.30 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3654915 | 0.85 | GSK3B (0.33) | DHODHGSK3BKMT2A | |
| SCHEMBL4023651 | 0.83 | DYRK1A (0.33) | DYRK1ALIPG | |
| SCHEMBL3652261 | 0.83 | DHODH (0.35) | DYRK1ADHODHLIPGLIPCCHRM4 | |
| SCHEMBL3652576 | 0.82 | DYRK1A (0.34) | DYRK1ADHODHCYP2D6KMT2A | |
| SCHEMBL3804665 | 0.82 | DYRK1A (0.34) | DYRK1ALIPGLIPC | |
| SCHEMBL3654414 | 0.81 | DYRK1A (0.34) | DYRK1A | |
| SCHEMBL3649952 | 0.81 | ABCC9 (0.36) | LIPGLIPCKMT2A | |
| SCHEMBL3654949 | 0.81 | AGTR2 (0.33) | LIPGLIPC | |
| SCHEMBL3650566 | 0.81 | DYRK1A (0.33) | DYRK1A | |
| SCHEMBL3645628 | 0.80 | DYRK1A (0.40) | DYRK1ADHODHLIPGLIPCCHRM4 |
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 |