Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PKLR | P30613 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31191954 | 0.86 | PTGS2 (0.50) | PTGS2ALDH1A1CA12CA9MAPT | |
| SCHEMBL5203826 | 0.84 | CA12 (0.43) | PTGS2ALDH1A1PKMCA12CA9 | |
| SCHEMBL7216396 | 0.84 | GRM5 (0.51) | P2RY6ACACBALOX5 | |
| SCHEMBL6755749 | 0.80 | ALOX5 (0.43) | ALDH1A1NPC1RAB9AMAOBALOX5 | |
| SCHEMBL6755727 | 0.78 | CA12 (0.46) | PTGS2ALDH1A1CA12CA9SMN1; SMN2 | |
| SCHEMBL6756847 | 0.78 | MEN1 (0.37) | ALDH1A1MAPTP2RY6MAOBALOX5 | |
| SCHEMBL6756803 | 0.78 | MEN1 (0.52) | PTGS2ALDH1A1CA12CA9MAPT | |
| SCHEMBL6756877 | 0.75 | MTNR1A (0.52) | PTGS2ALDH1A1CA12CA9MAPT | |
| SCHEMBL7677996 | 0.75 | CCR5 (0.43) | ALOX5 | |
| SCHEMBL913383 | 0.74 | ALOX5 (0.49) | PTGS2ALDH1A1PKMCA12CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1040103-B1 | ANILIDE DERIVATIVE, PRODUCTION AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2007-03-14 | — | — | EP | disclosed |