Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 3/20 | 0.44 |
| ▸ | METAP2 | P50579 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 2/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13863582 | 0.87 | ALDH1A1 (0.49) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL18202008 | 0.86 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL807820 | 0.81 | NPC1 (0.62) | ALDH1A1HSD17B10CYP1A2IDO1METAP2 | |
| SCHEMBL13065794 | 0.80 | CYP1A2 (0.47) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL14341062 | 0.75 | CYP2A6 (0.61) | ALDH1A1HSD17B10CYP1A2HPGDCYP3A4 | |
| SCHEMBL3826324 | 0.75 | L3MBTL1 (0.50) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL3831411 | 0.75 | CASP3 (0.50) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL14479276 | 0.75 | L3MBTL1 (0.47) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL13863872 | 0.75 | MAOA (0.37) | ALDH1A1HSD17B10CYP1A2HPGDIDO1 | |
| SCHEMBL18201976 | 0.74 | MAPT (0.42) | ALDH1A1HSD17B10CYP1A2HPGDNPC1 |
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-2217607-B1 | ORGANIC METAL COMPLEX, AND ORGANIC LIGHT EMITTING DEVICE AND DISPLAY APPARATUS USING THE SAME | CANON KK (JP) | 2016-11-02 | — | — | EP | disclosed |