Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 4/20 | 0.50 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.43 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | CCR8 | P51685 | 1/20 | 0.37 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16189088 | 0.89 | MKNK1 (0.54) | DHODHMKNK1MKNK2CYP2A6MAPT | |
| SCHEMBL9612955 | 0.88 | DHODH (0.47) | DHODHMKNK1MKNK2CYP2A6ALDH1A1 | |
| SCHEMBL9612969 | 0.85 | DHODH (0.47) | DHODHMKNK1MKNK2CYP2A6MAPT | |
| SCHEMBL21790966 | 0.84 | CYP2A6 (0.50) | DHODHDHFRCYP2A6ENPP3ENPP1 | |
| SCHEMBL18174795 | 0.84 | DHODH (0.46) | DHODHMKNK1MKNK2HSD17B10CA12 | |
| SCHEMBL10032759 | 0.83 | DHODH (0.48) | DHODHMKNK1MKNK2CYP2A6CCR1 | |
| SCHEMBL15161030 | 0.82 | MKNK1 (0.48) | DHODHMKNK1MKNK2HSD17B10CA12 | |
| SCHEMBL18174748 | 0.82 | DHODH (0.50) | DHODHMKNK1MKNK2CYP2A6ENPP3 | |
| SCHEMBL18174786 | 0.82 | DHODH (0.47) | DHODHMKNK1MKNK2CA12CA1 | |
| SCHEMBL21033795 | 0.81 | CYP2A6 (0.57) | DHODHDHFRCYP2A6ENPP3ENPP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012070535-A1 | ELECTRON TRANSPORT MATERIAL, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | JNC株式会社 (JP) | 2012-05-31 | — | — | WO | disclosed |