Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | GP6 | Q9HCN6 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15749798 | 0.85 | P2RX7 (0.49) | P2RX7NISCHALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17851200 | 0.84 | P2RX7 (0.40) | P2RX7NISCHGP6ALDH1A1CYP1A2 | |
| SCHEMBL18561425 | 0.83 | P2RX7 (0.39) | P2RX7NISCHGP6ALDH1A1CYP1A2 | |
| SCHEMBL18820842 | 0.82 | P2RX7 (0.42) | P2RX7NISCHALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL18561432 | 0.82 | P2RX7 (0.38) | P2RX7NISCHGP6ALDH1A1CYP1A2 | |
| SCHEMBL18561422 | 0.81 | KDM4E (0.35) | P2RX7 | |
| SCHEMBL18561430 | 0.79 | P2RX7 (0.41) | P2RX7NISCHGP6ALDH1A1CYP1A2 | |
| SCHEMBL20226293 | 0.78 | P2RX7 (0.40) | P2RX7NISCHGP6ALDH1A1CYP1A2 | |
| SCHEMBL17726028 | 0.77 | P2RX7 (0.39) | P2RX7NISCHGP6ALDH1A1CYP1A2 | |
| SCHEMBL20226279 | 0.77 | P2RX7 (0.39) | P2RX7NISCHGP6ALDH1A1CYP1A2 |
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-2695882-B1 | ORGANIC COMPOUND, CHARGE TRANSPORT MATERIAL, COMPOSITION CONTAINING SAID COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE | MITSUBISHI CHEM CORP (JP) | 2017-03-01 | — | — | EP | disclosed |