Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | CASP1 | P29466 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.40 |
| ▸ | TYMS | P04818 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1628034 | 0.91 | ALDH1A1 (0.58) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL953211 | 0.75 | GABRA1 (0.48) | ALDH1A1HSD17B10HPGDTSHRCYP1B1 | |
| SCHEMBL16201010 | 0.72 | ALDH1A1 (0.48) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL4600959 | 0.71 | ALOX15 (0.41) | GABRA1GABRB2 | |
| SCHEMBL14069869 | 0.71 | ALOX15 (0.41) | GABRA1GABRB2 | |
| SCHEMBL1687837 | 0.69 | ALDH1A1 (0.42) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL1628028 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL458671 | 0.68 | ALDH1A1 (0.65) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL23709241 | 0.68 | ALDH1A1 (0.65) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| Benzo(K)Fluoranthene SCHEMBL175484 | 0.67 | ALDH1A1 (1.00) | ALDH1A1HSD17B10HPGDCASP1TSHR |
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-2200104-B1 | Organic light-emitting device | CANON KK (JP) | 2019-09-04 | — | — | EP | disclosed |