Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2488347 | 0.94 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1TRPM8POLB | |
| SCHEMBL5933542 | 0.89 | ALDH1A1 (0.48) | ALDH1A1TRPM8SMN1; SMN2CYP2C19TSHR | |
| SCHEMBL2091758 | 0.83 | TRPM8 (0.56) | ALDH1A1KMT2AMEN1TRPM8POLB | |
| SCHEMBL2090319 | 0.83 | NPSR1 (0.54) | ALDH1A1KMT2AMEN1TRPM8POLB | |
| SCHEMBL16969128 | 0.80 | ACHE (0.52) | ALDH1A1KMT2ATRPM8SMN1; SMN2CYP1A2 | |
| SCHEMBL10566831 | 0.78 | GAA (0.41) | ALDH1A1KMT2ATRPM8SMN1; SMN2MAPT | |
| SCHEMBL2490876 | 0.78 | TRPM8 (0.51) | ALDH1A1KMT2AMEN1TRPM8POLB | |
| SCHEMBL517256 | 0.75 | MT-CO2 (0.42) | ALDH1A1KMT2AMEN1POLBHTT | |
| SCHEMBL23714860 | 0.73 | ALDH1A1 (0.68) | ALDH1A1KMT2AMEN1POLBHTT | |
| SCHEMBL2858875 | 0.73 | ALDH1A1 (0.68) | ALDH1A1KMT2AMEN1POLBHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2379476-A1 | NOVEL COMPOUNDS, DERIVATIVES THEREOF AND THEIR USE IN HETEROJUNCTION DEVICES | The University of Melbourne (AU) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010060160-A1 | NOVEL COMPOUNDS, DERIVATIVES THEREOF AND THEIR USE IN HETEROJUNCTION DEVICES | THE UNIVERSITY OF MELBOURNE (AU) | 2010-06-03 | — | — | WO | disclosed |
| WO-2010060159-A1 | NOVEL BLOCK COPOLYMERS, METHODS OF PREPARATION AND THEIR USE IN HETEROJUNCTION DEVICES | THE UNIVERSITY OF MELBOURNE (AU) | 2010-06-03 | — | — | WO | disclosed |