Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | STAT6 | P42226 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 2/20 | 0.38 |
| ▸ | PTPRC | P08575 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10604381 | 0.93 | ALDH1A1 (0.40) | ALDH1A1CYP1A2CYP3A4MAPK1TP53 | |
| SCHEMBL4543383 | 0.77 | ALDH1A1 (0.47) | ALDH1A1MAPK1MAPTS100A4PTPRC | |
| SCHEMBL11212007 | 0.75 | MAPT (0.55) | ALDH1A1CYP1A2CYP3A4MAPK1TP53 | |
| SCHEMBL11818043 | 0.74 | MAPT (0.54) | ALDH1A1CYP1A2CYP3A4MAPK1TP53 | |
| SCHEMBL8951807 | 0.72 | CTSB (0.56) | ALDH1A1CYP1A2CYP3A4MAPK1TP53 | |
| SCHEMBL13346218 | 0.72 | MAPT (0.51) | ALDH1A1CYP1A2CYP3A4MAPK1TP53 | |
| SCHEMBL10607788 | 0.72 | CYP1A2 (0.59) | ALDH1A1CYP1A2CYP3A4MAPK1TP53 | |
| SCHEMBL10611588 | 0.70 | ADORA2A (0.46) | ALDH1A1CYP1A2MAPTL3MBTL1P2RY2 | |
| SCHEMBL7967638 | 0.69 | ALDH1A1 (0.45) | ALDH1A1MAPK1MAPTS100A4PTPRC | |
| Chlorobenzene SCHEMBL10892649 | 0.69 | CYP1A1 (0.36) | CYP1A2MAPK1MAPTPOLBP2RY2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0111197-B1 | ANTHRAQUINONE DYES, THEIR PREPARATION AND USE, AS WELL AS DICHROIC MATERIAL CONTAINING ANTHRAQUINONE DYES | BAYER AG (DE) | 1989-11-08 | — | — | EP | disclosed |
| US-4596666-A | Aryl-mercapto anthraquinone dyestuffs, their preparation and use and dichroic material containing aryl-mercapto anthraquinone dyestuffs | BAYER AKTIENGESELLSCHAFT (DE) | 1986-06-24 | — | — | US | disclosed |