Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.37 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.37 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HK1 | P19367 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL594087 | 0.86 | NPC1 (0.41) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| SCHEMBL20477944 | 0.73 | NPC1 (0.43) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| SCHEMBL29504825 | 0.69 | PLAU (0.43) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| SCHEMBL170456 | 0.69 | PLAU (0.43) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| SCHEMBL31312839 | 0.67 | PLAU (0.42) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| Hydrochloric Acid SCHEMBL10824104 | 0.67 | PLAU (0.42) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| SCHEMBL8827973 | 0.67 | PLAU (0.42) | NPC1PLAUMAPK13MAPK12MAPK11 | |
| SCHEMBL862128 | 0.66 | TSHR (0.56) | PLAUHTR2CTSHR | |
| SCHEMBL862127 | 0.66 | TSHR (0.56) | PLAUHTR2CTSHR | |
| SCHEMBL4133596 | 0.65 | PARP1 (0.36) | HTR2CTSHR |
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-2301921-A1 | POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | Idemitsu Kosan Co., Ltd. (JP) | 2011-03-30 | — | — | EP | disclosed |