Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | STAT6 | P42226 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 2/20 | 0.36 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL10605992 | 0.93 | ALDH1A1 (0.42) | ALDH1A1MAPK1CYP1A2CYP3A4TP53 | |
| SCHEMBL7967638 | 0.78 | ALDH1A1 (0.45) | ALDH1A1MAPK1MAPTS100A4PTPRC | |
| Chlorobenzene SCHEMBL10892649 | 0.76 | CYP1A1 (0.36) | MAPK1CYP1A2MAPTPOLBP2RY2 | |
| SCHEMBL10607774 | 0.74 | ADORA2A (0.47) | CYP1A2MAPTS100A4P2RY2CYP1A1 | |
| SCHEMBL11212007 | 0.73 | MAPT (0.55) | ALDH1A1MAPK1CYP1A2CYP3A4TP53 | |
| SCHEMBL11818043 | 0.72 | MAPT (0.54) | ALDH1A1MAPK1CYP1A2CYP3A4TP53 | |
| SCHEMBL13346218 | 0.70 | MAPT (0.51) | ALDH1A1MAPK1CYP1A2CYP3A4TP53 | |
| SCHEMBL10607788 | 0.70 | CYP1A2 (0.59) | ALDH1A1MAPK1CYP1A2CYP3A4TP53 | |
| SCHEMBL8951807 | 0.70 | CTSB (0.56) | ALDH1A1MAPK1CYP1A2CYP3A4TP53 | |
| SCHEMBL4543383 | 0.70 | ALDH1A1 (0.47) | ALDH1A1MAPK1MAPTS100A4PTPRC |
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 3 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 |
| EP-0111197-A2 | Anthraquinone dyes, their preparation and use, as well as dichroic material containing anthraquinone dyes | BAYER AG (DE) | 1984-06-20 | — | — | EP | disclosed |