Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 8/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 8/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.35 |
| ▸ | TSHR | P16473 | 7/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | USP2 | O75604 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL19258273 | 0.84 | PRKDC (0.32) | PRKDC | |
| SCHEMBL19258223 | 0.83 | PRKDC (0.33) | PRKDCNR3C1NR3C2SCN9A | |
| SCHEMBL19258028 | 0.82 | SIGMAR1 (0.37) | CLK4CYP2D6CYP2C19CYP1A2TSHR | |
| SCHEMBL20809144 | 0.82 | SIK2 (0.34) | CLK4ADORA2AKDRPRKDCTRPV1 | |
| SCHEMBL20809139 | 0.81 | TRPV1 (0.33) | ALDH1A1ADORA2APRKDCTRPV1SCN9A | |
| SCHEMBL19257824 | 0.81 | SCN9A (0.43) | GRM2SCN9A | |
| SCHEMBL26060421 | 0.79 | GRM2 (0.33) | GRM2MAPK14 | |
| SCHEMBL19258239 | 0.71 | ADORA2A (0.56) | CLK4CYP2D6CYP2C19CYP1A2TSHR | |
| SCHEMBL26060352 | 0.71 | — | — | |
| SCHEMBL19258252 | 0.70 | LMNA (0.41) | CLK4CYP2D6CYP2C19CYP1A2TSHR |
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-3205658-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | Universal Display Corporation (US) | 2017-08-16 | — | — | EP | disclosed |