Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | HRH2 | P25021 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 8/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | ATP4A | P20648 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ATP4B | P51164 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11368363 | 0.89 | CYP3A4 (0.43) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL11366188 | 0.81 | CYP3A4 (0.60) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL11355242 | 0.76 | CYP3A4 (0.48) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL9330227 | 0.75 | HSD17B10 (0.36) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL9328930 | 0.75 | HSD17B10 (0.36) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL11368398 | 0.75 | HSD17B10 (0.32) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL11466140 | 0.75 | CYP3A4 (0.43) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL11368315 | 0.75 | HSD17B10 (0.32) | CYP3A4CYP2D6HRH2MAPTHRH4 | |
| SCHEMBL2760171 | 0.73 | RAB9A (0.39) | MEN1KMT2ASMN1; SMN2NPC1HSP90AA1 | |
| SCHEMBL166920 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0364844-B1 | Insecticidally active cyano compounds | BAYER AGROCHEM KK (JP) | 1994-03-16 | — | — | EP | claimed |
| EP-0364844-B1 | Insecticidally active cyano compounds | BAYER AGROCHEM KK (JP) | 1994-03-16 | — | — | EP | disclosed |