Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.39 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | F11 | P03951 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20903516 | 0.84 | KAT6A (0.49) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL20903485 | 0.81 | KAT6A (0.44) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL20903564 | 0.79 | SMN1; SMN2 (0.41) | CYP1A2CYP3A4MEN1ALDH1A1KMT2A | |
| SCHEMBL20903501 | 0.78 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL20903478 | 0.78 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL20903477 | 0.76 | KAT6A (0.51) | ABCG2KAT6AGABRA1GABRG2GABRB3 | |
| SCHEMBL26423776 | 0.74 | ABCG2 (0.41) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL23020125 | 0.74 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL26572191 | 0.74 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2D6CLK4MEN1 | |
| SCHEMBL22812706 | 0.73 | ADORA3 (0.33) | CLK4MEN1ALDH1A1KMT2ALMNA |
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-3470398-A1 | ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTOR LAYER | Novaled GmbH (DE) | 2019-04-17 | — | — | EP | disclosed |