Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.31 |
| ▸ | PTGDR | Q13258 | 2/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3696613 | 0.89 | SLC16A3 (0.37) | TRPM8 | |
| SCHEMBL3705296 | 0.89 | NAMPT (0.34) | PTGDR2 | |
| SCHEMBL3688572 | 0.88 | RIPK1 (0.34) | TRPM8 | |
| SCHEMBL3704890 | 0.88 | P2RX7 (0.34) | PRCPP2RX7PTGDR2PTGDRTRPM8 | |
| SCHEMBL3703586 | 0.87 | ALDH1A1 (0.33) | TRPA1TRPM8HTR2AHTR2CKCNH2 | |
| SCHEMBL3700979 | 0.86 | KCNQ3 (0.34) | TRPA1HTR2AHTR2CKCNH2 | |
| SCHEMBL3700610 | 0.86 | SLC16A3 (0.33) | HTR2AHTR2CKCNH2 | |
| SCHEMBL3706787 | 0.86 | CNR1 (0.32) | — | |
| SCHEMBL3700701 | 0.85 | RXRA (0.32) | HTR2AHTR2CKCNH2 | |
| SCHEMBL3698342 | 0.85 | NAMPT (0.31) | — |
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 |