Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 7/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL6909288 | 1.00 | GAA (0.57) | GAAKMT2AMEN1ALOX5APP | |
| Ethylene SCHEMBL1805199 | 1.00 | GAA (0.57) | GAAKMT2AMEN1ALOX5APP | |
| Ethylene SCHEMBL1191582 | 0.97 | GAA (0.57) | GAAKMT2AMEN1ALOX5APP | |
| SCHEMBL208761 | 0.97 | GAA (0.60) | GAAKMT2AMEN1ALOX5APP | |
| SCHEMBL20390739 | 0.94 | GAA (0.57) | GAAKMT2AMEN1ALOX5APP | |
| SCHEMBL11813027 | 0.92 | GAA (0.56) | GAAKMT2AMEN1ALOX5APP | |
| SCHEMBL10399184 | 0.92 | GAA (0.56) | GAAKMT2AMEN1ALOX5APP | |
| Cyclohexane SCHEMBL676099 | 0.92 | GAA (0.56) | GAAKMT2AMEN1ALOX5APP | |
| SCHEMBL858491 | 0.92 | GAA (0.56) | GAAKMT2AMEN1ALOX5APP | |
| SCHEMBL808431 | 0.92 | GAA (0.56) | GAAKMT2AMEN1ALOX5APP |
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-1562589-B1 | DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES | VERTEX PHARMA (US) | 2009-01-07 | — | — | EP | disclosed |