Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | APP | P05067 | 2/20 | 0.61 |
| ▸ | BCHE | P06276 | 2/20 | 0.61 |
| ▸ | ACHE | P22303 | 2/20 | 0.61 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13194932 | 0.88 | APP (0.68) | NPSR1MAPK1APPBCHEACHE | |
| SCHEMBL9970675 | 0.86 | APP (0.59) | ALDH1A1NPSR1TP53ALOX15MAPK1 | |
| SCHEMBL11452149 | 0.82 | GAA (0.66) | ALDH1A1NPSR1TP53ALOX15MAPK1 | |
| SCHEMBL3298289 | 0.78 | KCNH3 (0.73) | ALDH1A1NPSR1APPGAAPOLB | |
| SCHEMBL23786263 | 0.76 | KCNH3 (0.56) | GAAPOLBKCNH3SMN1; SMN2 | |
| SCHEMBL28674495 | 0.75 | GAA (0.58) | ALDH1A1NPSR1TP53ALOX15MAPK1 | |
| SCHEMBL13208246 | 0.75 | GAA (0.58) | ALDH1A1NPSR1TP53ALOX15MAPK1 | |
| SCHEMBL3287040 | 0.74 | KCNH3 (0.60) | ALDH1A1TP53MAPK1APPCA1 | |
| Atrazine SCHEMBL20723465 | 0.74 | GAA (0.73) | ALDH1A1GAAPOLBTSHRLMNA | |
| Atrazine SCHEMBL4306269 | 0.74 | GAA (0.73) | ALDH1A1GAAPOLBTSHRLMNA |
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-2012083190-A1 | INSECT ODORANT RECEPTOR ANTAGONISTS | THE ROCKEFELLER UNIVERSITY (US) | 2012-06-21 | — | — | WO | disclosed |