Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PI4KA | P42356 | 1/20 | 0.37 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.37 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.37 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13180099 | 0.77 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1HCAR1ALDH1A1TSHR | |
| SCHEMBL15006750 | 0.76 | POLB (0.46) | HCAR1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL7563960 | 0.75 | ATM (0.53) | HSP90AA1HSP90AB1ALDH1A1GAAGABRA5 | |
| SCHEMBL28073055 | 0.72 | CYP2A6 (0.42) | HSP90AA1HSP90AB1HCAR1ALDH1A1MGLL | |
| SCHEMBL17893848 | 0.72 | ALDH1A1 (0.48) | HSP90AA1HSP90AB1HCAR1ALDH1A1GRM1 | |
| SCHEMBL13145112 | 0.71 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1HCAR1ALDH1A1TSHR | |
| SCHEMBL4800521 | 0.71 | HSP90AA1 (0.44) | HSP90AA1HSP90AB1HCAR1ALDH1A1PI4KA | |
| SCHEMBL22732231 | 0.71 | HSP90AA1 (0.44) | HSP90AA1HSP90AB1HCAR1ALDH1A1PI4KA | |
| SCHEMBL17940712 | 0.71 | MAPK14 (0.49) | HSP90AA1ALDH1A1TSHRMGLLGRM1 | |
| SCHEMBL17940683 | 0.70 | HCAR1 (0.37) | HSP90AA1HCAR1ALDH1A1MAPTHPGD |
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-105820122-A | Organic electroluminescent material and device | 环球展览公司 | 2016-08-03 | — | — | CN | disclosed |