Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.37 |
| ▸ | S100A4 | P26447 | 1/20 | 0.36 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18615369 | 1.00 | ALDH1A1 (0.38) | ALDH1A1MAPK1PDK2S100A4MALT1 | |
| SCHEMBL429929 | 0.96 | ALDH1A1 (0.41) | ALDH1A1MAPK1PDK2S100A4MALT1 | |
| SCHEMBL29294792 | 0.90 | PDK2 (0.42) | ALDH1A1PDK2S100A4MALT1MAPT | |
| SCHEMBL29458875 | 0.90 | PDK2 (0.42) | ALDH1A1PDK2S100A4MALT1MAPT | |
| SCHEMBL5063493 | 0.90 | PDK2 (0.42) | ALDH1A1PDK2S100A4MALT1MAPT | |
| SCHEMBL5013191 | 0.90 | PDK2 (0.42) | ALDH1A1PDK2S100A4MALT1MAPT | |
| SCHEMBL29403081 | 0.86 | PDK2 (0.44) | PDK2S100A4MALT1PGRAKR1A1 | |
| SCHEMBL29587737 | 0.86 | PDK2 (0.44) | PDK2S100A4MALT1PGRAKR1A1 | |
| SCHEMBL204806 | 0.86 | PDK2 (0.44) | PDK2S100A4MALT1PGRAKR1A1 | |
| SCHEMBL15315869 | 0.85 | ALDH1A1 (0.41) | ALDH1A1MAPK1PDK2S100A4MALT1 |
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-1860097-B1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE UTILIZING THE SAME | IDEMITSU KOSAN CO (JP) | 2011-08-10 | — | — | EP | disclosed |