Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.55 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.55 |
| ▸ | SCN1A | P35498 | 3/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.55 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.55 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | SLC22A2 | O15244 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL1612723 | 0.94 | CYP2D6 (0.60) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL4305 | 0.87 | CYP2D6 (0.63) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| Sulfuric Acid SCHEMBL19100311 | 0.85 | KDM4E (0.66) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL669873 | 0.83 | CYP2D6 (0.64) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL22862890 | 0.81 | KDM4E (0.66) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL15239796 | 0.80 | KDM4E (0.64) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL4278098 | 0.79 | CYP2D6 (0.65) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| Sulfuric Acid SCHEMBL9614123 | 0.78 | KDM4E (0.67) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL2150774 | 0.78 | KDM4E (0.61) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 | |
| SCHEMBL789401 | 0.78 | KDM4E (0.59) | CYP2D6KDM4EALDH1A1ABCB1SLC22A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5100666-A | Improved half-life | MONSANTO COMPANY (US) | 1992-03-31 | — | — | US | disclosed |