Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3757915 | 0.96 | CYP3A4 (0.46) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL9825741 | 0.81 | LMNA (0.43) | CYP2C9CYP2C19CYP2D6TDP1ALDH1A1 | |
| SCHEMBL1685335 | 0.74 | CYP3A4 (0.47) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL28492099 | 0.73 | ALDH1A1 (0.47) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL6404697 | 0.72 | SCN1A (0.51) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL4580676 | 0.71 | ALDH1A1 (0.44) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL24707014 | 0.70 | TDP1 (0.45) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL6400041 | 0.69 | ALDH1A1 (0.41) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL6399681 | 0.69 | TDP1 (0.44) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 | |
| SCHEMBL109766 | 0.68 | MEN1 (0.52) | CYP2C9CYP2C19CYP3A4CYP2D6TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0029595-A1 | An improved high solids coating composition of a low molecular weight glycidyl acrylic polymer and an alkylated melamine cross-linking agent, and a substrate coated therewith | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-06-03 | — | — | EP | disclosed |