Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 9/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.61 |
| ▸ | MAPT | P10636 | 8/20 | 0.61 |
| ▸ | GAA | P10253 | 8/20 | 0.61 |
| ▸ | RAB9A | P51151 | 6/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.61 |
| ▸ | RELA | Q04206 | 3/20 | 0.61 |
| ▸ | RECQL | P46063 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 7/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | VCP | P55072 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4066150 | 0.92 | PLAU (0.57) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4239559 | 0.90 | PLAU (0.52) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4233688 | 0.89 | MEN1 (0.50) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4067193 | 0.87 | VCP (0.57) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4242424 | 0.87 | ALOX5 (0.54) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4056618 | 0.85 | TUBB4A (0.58) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4065329 | 0.84 | PKM (0.47) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL4238355 | 0.83 | MAPT (0.55) | MEN1KMT2AMAPTGAARAB9A | |
| SCHEMBL12298170 | 0.83 | MAPT (0.54) | AMY1AMEN1KMT2AMAPTGAA | |
| SCHEMBL12297213 | 0.82 | AMY1A (0.42) | AMY1AMEN1KMT2AMAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009010871-A2 | PYRAZOLE DERIVATIVES AS ANTAGONISTS OF ADENOSINE A3 RECEPTOR | ADDEX PHARMA S.A. (CH) | 2009-01-22 | — | — | WO | disclosed |