Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.34 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.34 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.34 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.34 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.32 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL3693161 | 0.91 | NAMPT (0.36) | PTGDR2ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL3700979 | 0.87 | KCNQ3 (0.34) | CNR2MAPTHTR2AHTR2CKCNH2 | |
| SCHEMBL3697140 | 0.87 | SLC16A3 (0.34) | ABCC9ABCC8KCNJ11KCNJ8HTR6 | |
| SCHEMBL4125913 | 0.85 | KMT2A (0.36) | PTGDR2HTR6MAPTHTR2AHTR2C | |
| SCHEMBL3700744 | 0.85 | PTGDR2 (0.33) | PTGDR2ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL3808574 | 0.84 | ABCC9 (0.35) | ABCC9ABCC8KCNJ11KCNJ8MAPT | |
| SCHEMBL476326 | 0.84 | COMT (0.36) | PTGDR2HTR6MAPTPTGDRPTGER2 | |
| SCHEMBL3705296 | 0.83 | NAMPT (0.34) | PTGDR2ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL3699024 | 0.82 | HTR2C (0.46) | PTGDR2CNR2HTR6HTR2AHTR2C | |
| SCHEMBL3700610 | 0.81 | SLC16A3 (0.33) | ABCC9ABCC8KCNJ11KCNJ8HTR2A |
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 |