Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 13/20 | 0.37 |
| ▸ | SLC16A1 | P53985 | 12/20 | 0.37 |
| ▸ | GCK | P35557 | 3/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | FPR1 | P21462 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4125824 | 0.87 | SLC16A3 (0.38) | SLC16A3SLC16A1GCKPDE4BKCNH2 | |
| SCHEMBL4201755 | 0.85 | SLC16A3 (0.36) | SLC16A3SLC16A1PDE4BMEN1KMT2A | |
| SCHEMBL3029606 | 0.83 | SLC16A3 (0.38) | SLC16A3SLC16A1PDE4BMEN1KMT2A | |
| SCHEMBL3702181 | 0.83 | SLC16A3 (0.37) | SLC16A3SLC16A1GCKPDE4BKCNH2 | |
| SCHEMBL3698137 | 0.82 | HTR2C (0.49) | SLC16A3SLC16A1MEN1KMT2A | |
| SCHEMBL3694441 | 0.82 | SLC16A3 (0.40) | SLC16A3SLC16A1PDE4B | |
| SCHEMBL3701902 | 0.82 | SLC16A3 (0.38) | SLC16A3SLC16A1PDE4BMEN1KMT2A | |
| SCHEMBL3700575 | 0.81 | SLC16A3 (0.40) | SLC16A3SLC16A1PDE4B | |
| SCHEMBL3698138 | 0.80 | SLC16A3 (0.38) | SLC16A3SLC16A1GCKKCNH2FPR1 | |
| SCHEMBL3692824 | 0.80 | SLC16A3 (0.36) | SLC16A3SLC16A1PDE4B |
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 |