Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.33 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NAMPT | P43490 | 2/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KDM6B | O15054 | 1/20 | 0.30 |
| ▸ | ALKBH2 | Q6NS38 | 1/20 | 0.30 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.30 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1278370 | 0.97 | EPHX1 (0.35) | HCAR2EPHX1PDCD1CD274KAT5 | |
| Fumaric Acid SCHEMBL1278367 | 0.90 | NAMPT (0.35) | EPHX1PDCD1CD274MEN1POLB | |
| Fumaric Acid SCHEMBL1278371 | 0.90 | NAMPT (0.35) | EPHX1PDCD1CD274MEN1POLB | |
| SCHEMBL1278824 | 0.89 | EPHX1 (0.36) | EPHX1ALDH1A1NAMPTHDAC1TSHR | |
| Fumaric Acid SCHEMBL1278489 | 0.86 | NAMPT (0.40) | MEN1POLBKMT2AL3MBTL1ALDH1A1 | |
| Fumaric Acid SCHEMBL1278492 | 0.86 | NAMPT (0.40) | MEN1POLBKMT2AL3MBTL1ALDH1A1 | |
| Fumaric Acid SCHEMBL1278703 | 0.85 | KAT8 (0.36) | MEN1POLBKMT2AL3MBTL1KAT5 | |
| Fumaric Acid SCHEMBL1278699 | 0.85 | KAT8 (0.36) | MEN1POLBKMT2AL3MBTL1KAT5 | |
| SCHEMBL4792253 | 0.85 | HCAR2 (0.32) | HCAR2MEN1POLBKMT2AL3MBTL1 | |
| Fumaric Acid SCHEMBL1278205 | 0.85 | KAT5 (0.36) | MEN1POLBKMT2AL3MBTL1KAT5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1919865-A1 | 1-HETEROCYCLYLSULFONYL, 2-AMINOMETHYL, 5- (HETERO-) ARYL SUBSTITUTED 1-H-PYRROLE DERIVATIVES AS ACID SECRETION INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026916-A1 | 1-HETEROCYCLYLSULFONYL, 2-AMINOMETHYL, 5- (HETERO-) ARYL SUBSTITUTED 1-H-PYRROLE DERIVATIVES AS ACID SECRETION INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-03-08 | — | — | WO | disclosed |