Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11435662 | 0.80 | GAA (0.38) | CYP3A4CYP2C9CYP2C19GAASMN1; SMN2 | |
| SCHEMBL8099688 | 0.78 | CYP3A4 (0.36) | CYP3A4CYP2C9CYP2C19DGAT1GAA | |
| SCHEMBL11442582 | 0.72 | CYP3A4 (0.32) | CYP3A4CYP2C9CYP2C19DGAT1GAA | |
| SCHEMBL10308649 | 0.72 | TSHR (0.40) | CYP2C9CYP2C19GAATP53TDP1 | |
| SCHEMBL11431291 | 0.69 | DGAT1 (0.33) | DGAT1 | |
| SCHEMBL1240221 | 0.68 | CYP3A4 (0.33) | CYP3A4CYP2C9CYP2C19DGAT1GAA | |
| SCHEMBL11430898 | 0.66 | DGAT1 (0.37) | DGAT1 | |
| SCHEMBL7473418 | 0.65 | DGAT1 (0.35) | DGAT1TP53TDP1CA12CA1 | |
| SCHEMBL14819108 | 0.64 | CA1 (0.39) | CYP3A4CYP2C9CYP2C19GAATDP1 | |
| SCHEMBL7674935 | 0.64 | DGAT1 (0.43) | DGAT1GAACA12CA1CA2 |
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-4228109-A | HERBICIDES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-10-14 | — | — | US | claimed |