Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | CHUK | O15111 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 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 | |
|---|---|---|---|---|
| SCHEMBL1415647 | 0.87 | DAPK1 (0.36) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL1945538 | 0.84 | DAPK1 (0.35) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL934717 | 0.81 | SMN1; SMN2 (0.34) | ALDH1A1HPGDHTTTSHRSMN1; SMN2 | |
| SCHEMBL13713297 | 0.77 | HPGD (0.36) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL13713295 | 0.73 | DAPK1 (0.34) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL12027184 | 0.72 | DAPK1 (0.36) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL12539988 | 0.71 | DAPK1 (0.38) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL4062495 | 0.70 | DAPK1 (0.38) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL13713523 | 0.70 | SMN1; SMN2 (0.34) | ALDH1A1MAPK1HPGDHTTTSHR | |
| SCHEMBL1415865 | 0.70 | ALDH1A1 (0.35) | ALDH1A1MAPK1HPGDHTTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-8853224-B2 | Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases | INDUSTRIAL RESEARCH LIMITED (NZ) | 2014-10-07 | — | — | US | disclosed |