Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 12/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.53 |
| ▸ | KMO | O15229 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 12/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 6/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28273372 | 0.82 | CYP3A4 (0.39) | CYP1A2CYP3A4KMOCYP2C19CYP2D6 | |
| SCHEMBL10601314 | 0.80 | MAPK9 (0.43) | CYP2D6CLK4 | |
| SCHEMBL4166620 | 0.79 | TGFBR1 (0.56) | CYP1A2CYP3A4KMOCYP2C19CYP2D6 | |
| SCHEMBL31211635 | 0.79 | TGFBR1 (0.56) | CYP1A2CYP3A4KMOCYP2C19CYP2D6 | |
| SCHEMBL30090604 | 0.79 | TGFBR1 (0.56) | CYP1A2CYP3A4KMOCYP2C19CYP2D6 | |
| SCHEMBL28239064 | 0.77 | MAPK10 (0.43) | CYP1A2CYP3A4KMOCLK4P2RX7 | |
| SCHEMBL6220344 | 0.76 | ACP1 (0.40) | CYP1A2CYP3A4KMOCYP2C19CYP2D6 | |
| SCHEMBL28461573 | 0.76 | CYP3A4 (0.53) | CYP1A2CYP3A4KMOCYP2C19CYP2D6 | |
| SCHEMBL30141958 | 0.76 | NPC1 (0.46) | KMT2A | |
| SCHEMBL28296072 | 0.76 | NPC1 (0.46) | KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-107759571-A | Inhibitors of influenza viruses replication and its application method and purposes | 广东东阳光药业有限公司 | 2018-03-06 | — | — | CN | disclosed |