Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GRM8 | O00222 | 1/20 | 0.35 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PPOX | P50336 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | FUBP1 | Q96AE4 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.33 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8571938 | 0.84 | CYP1A2 (0.35) | CYP1A2TP53MAPTPOLBGRM8 | |
| SCHEMBL7521846 | 0.82 | ALDH1A1 (0.37) | CYP1A2TP53MAPTPOLBALDH1A1 | |
| SCHEMBL30130331 | 0.82 | ALDH1A1 (0.37) | CYP1A2TP53MAPTPOLBALDH1A1 | |
| SCHEMBL27500378 | 0.82 | LMNA (0.47) | MAPTALDH1A1PKMPPOXSMN1; SMN2 | |
| SCHEMBL27519042 | 0.81 | ALDH1A1 (0.39) | CYP1A2TP53MAPTPOLBALDH1A1 | |
| SCHEMBL7517826 | 0.77 | ALDH1A1 (0.41) | MAPTPOLBALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL27463655 | 0.77 | ALDH1A1 (0.37) | CYP1A2TP53MAPTPOLBALDH1A1 | |
| SCHEMBL5398257 | 0.76 | CYP1A2 (0.35) | CYP1A2MAPTHSP90AA1HSP90AB1PPOX | |
| SCHEMBL16911418 | 0.74 | PTGS2 (0.40) | CYP1A2TP53MAPTALDH1A1GRM8 | |
| SCHEMBL8566536 | 0.73 | PDE10A (0.33) | CYP1A2HSP90AA1HSP90AB1PPOXGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012000154-A1 | 5-ARYLMETHOXY PHENYL PYRAZOLE COMPOUNDS AND PREPARATION METHODS THEREOF | 大连理工大学 (CN) | 2012-01-05 | — | — | WO | disclosed |
| CN-101270117-A | Herbicide and preparation thereof | UNIV DALIAN TECH (CN) | 2008-09-24 | — | — | CN | disclosed |