Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | SLC16A3 | O15427 | 4/20 | 0.32 |
| ▸ | SLC16A1 | P53985 | 4/20 | 0.32 |
| ▸ | ABCC9 | O60706 | 3/20 | 0.32 |
| ▸ | ABCC8 | Q09428 | 3/20 | 0.32 |
| ▸ | KCNJ11 | Q14654 | 3/20 | 0.32 |
| ▸ | KCNJ8 | Q15842 | 3/20 | 0.32 |
| ▸ | HTR6 | P50406 | 4/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | COMT | P21964 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL476326 | 0.95 | COMT (0.36) | PTGDR2KMT2AHTR6KDM4ECOMT | |
| SCHEMBL3697999 | 0.93 | P2RX7 (0.33) | PTGDR2ALDH1A1SLC16A3SLC16A1ABCC9 | |
| SCHEMBL476415 | 0.92 | HTR6 (0.35) | ALDH1A1MEN1KMT2ASLC16A3SLC16A1 | |
| SCHEMBL476339 | 0.91 | HTR6 (0.32) | HTR6 | |
| SCHEMBL3705969 | 0.90 | SLC16A3 (0.39) | PTGDR2SLC16A3SLC16A1ABCC9ABCC8 | |
| SCHEMBL476395 | 0.89 | NAMPT (0.33) | — | |
| SCHEMBL3697762 | 0.88 | KDM4E (0.33) | PTGDR2ALDH1A1SLC16A3SLC16A1ABCC9 | |
| SCHEMBL3698418 | 0.88 | PTGDR2 (0.32) | PTGDR2MEN1KMT2ASLC16A3SLC16A1 | |
| SCHEMBL3697140 | 0.87 | SLC16A3 (0.34) | KMT2ASLC16A3SLC16A1ABCC9ABCC8 | |
| SCHEMBL3808574 | 0.86 | ABCC9 (0.35) | ALDH1A1SLC16A3SLC16A1ABCC9ABCC8 |
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 |