Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 10/20 | 0.39 |
| ▸ | SLC16A1 | P53985 | 8/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.37 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.36 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.36 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.36 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.34 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3700744 | 0.90 | PTGDR2 (0.33) | SLC16A3SLC16A1ABCC9ABCC8KCNJ11 | |
| SCHEMBL476415 | 0.89 | HTR6 (0.35) | SLC16A3SLC16A1ABCC9ABCC8KCNJ11 | |
| SCHEMBL3697999 | 0.89 | P2RX7 (0.33) | SLC16A3SLC16A1ABCC9ABCC8KCNJ11 | |
| SCHEMBL476339 | 0.89 | HTR6 (0.32) | — | |
| SCHEMBL4125764 | 0.88 | NFE2L2 (0.40) | SLC16A3SLC16A1NFE2L2METTAS2R14 | |
| SCHEMBL476326 | 0.87 | COMT (0.36) | PTGDR2 | |
| SCHEMBL476395 | 0.86 | NAMPT (0.33) | — | |
| SCHEMBL3697762 | 0.84 | KDM4E (0.33) | SLC16A3SLC16A1ABCC9ABCC8KCNJ11 | |
| SCHEMBL3705968 | 0.84 | SLC16A3 (0.39) | SLC16A3SLC16A1NFE2L2ABCC9ABCC8 | |
| SCHEMBL3703141 | 0.84 | CA1 (0.44) | SLC16A3SLC16A1NFE2L2MET |
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 |