Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 15/20 | 0.36 |
| ▸ | SLC16A1 | P53985 | 14/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 2/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.32 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3691770 | 0.90 | SLC16A3 (0.40) | SLC16A3SLC16A1PDE4BRXRANR1H2 | |
| SCHEMBL3696895 | 0.88 | SLC16A3 (0.44) | SLC16A3SLC16A1KDM4E | |
| SCHEMBL4118797 | 0.86 | SLC16A3 (0.36) | SLC16A3SLC16A1PDE4BKDM4EMEN1 | |
| SCHEMBL3702181 | 0.85 | SLC16A3 (0.37) | SLC16A3SLC16A1PDE4B | |
| SCHEMBL3696613 | 0.84 | SLC16A3 (0.37) | SLC16A3SLC16A1PDE4BP2RY1ALDH1A1 | |
| SCHEMBL3701584 | 0.84 | SLC16A3 (0.39) | SLC16A3SLC16A1PDE4BRXRANR1H2 | |
| SCHEMBL3696908 | 0.82 | ALDH1A1 (0.39) | SLC16A3SLC16A1MEN1ALDH1A1KMT2A | |
| SCHEMBL3701985 | 0.82 | HTR2C (0.43) | SLC16A3SLC16A1PDE4B | |
| SCHEMBL4201755 | 0.81 | SLC16A3 (0.36) | SLC16A3SLC16A1PDE4BP2RY1MEN1 | |
| SCHEMBL3698156 | 0.80 | KMT2A (0.38) | SLC16A3SLC16A1RXRANR1H2NR1H3 |
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 |