Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.43 |
| ▸ | NISCH | Q9Y2I1 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.33 |
| ▸ | MECP2 | P51608 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17196547 | 0.96 | P2RX7 (0.46) | P2RX7NISCHKMT2AALDH1A1HPGD | |
| SCHEMBL19622813 | 0.90 | P2RX7 (0.39) | P2RX7NISCHKMT2AALDH1A1HPGD | |
| SCHEMBL17735369 | 0.87 | MAOA (0.50) | P2RX7KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL19534243 | 0.83 | NISCH (0.41) | P2RX7NISCHKMT2AALDH1A1HPGD | |
| SCHEMBL12787062 | 0.78 | NISCH (0.43) | NISCHKMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL23784304 | 0.74 | RAB9A (0.46) | NISCHKMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL20226320 | 0.73 | P2RX7 (0.46) | P2RX7NISCHKMT2AALDH1A1HPGD | |
| SCHEMBL20226288 | 0.73 | P2RX7 (0.46) | P2RX7NISCHKMT2AALDH1A1HPGD | |
| SCHEMBL19007184 | 0.73 | P2RX7 (0.46) | P2RX7NISCHKMT2AALDH1A1HPGD | |
| SCHEMBL17117463 | 0.71 | NISCH (0.43) | NISCHALDH1A1HPGDKDM4EMAPT |
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-2017099516-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2017-06-15 | — | — | WO | disclosed |