Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL289322 | 0.90 | CYP2A6 (0.48) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| Hydrochloric Acid SCHEMBL289748 | 0.89 | CYP2A6 (0.47) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| SCHEMBL851867 | 0.84 | SMN1; SMN2 (0.51) | LMNAMAPTKDM4EMEN1KMT2A | |
| SCHEMBL29828863 | 0.81 | CYP3A4 (0.58) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| SCHEMBL18569063 | 0.80 | MAPT (0.57) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| SCHEMBL11386835 | 0.80 | KDM4E (0.72) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| SCHEMBL260103 | 0.79 | MAPT (0.56) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| SCHEMBL11387211 | 0.78 | CYP1A2 (0.66) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| SCHEMBL14242959 | 0.78 | CYP3A4 (0.58) | CYP3A4CYP1A2CYP2C19LMNAMAPT | |
| Formamide SCHEMBL16108314 | 0.77 | CYP3A4 (0.60) | CYP3A4CYP1A2CYP2C19LMNAMAPT |
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-2309857-A2 | HETEROCYCLIC COMPOUNDS USED AS PESTICIDES | Bayer CropScience AG (DE) | 2011-04-20 | — | — | EP | disclosed |
| WO-2010006713-A2 | HETEROCYCLIC COMPOUNDS USED AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2010-01-21 | — | — | WO | disclosed |