Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.56 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.56 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.56 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.56 |
| ▸ | S100A4 | P26447 | 1/20 | 0.50 |
| ▸ | NSD2 | O96028 | 3/20 | 0.49 |
| ▸ | TDP2 | O95551 | 2/20 | 0.49 |
| ▸ | HK1 | P19367 | 1/20 | 0.49 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29440919 | 0.90 | IDO1 (0.68) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| SCHEMBL119489 | 0.90 | IDO1 (0.68) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| Methylene Chloride SCHEMBL6033829 | 0.84 | IDO1 (0.60) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| Tert-Butanol SCHEMBL1458212 | 0.83 | IDO1 (0.54) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| Trifluoroacetic Acid SCHEMBL4267259 | 0.78 | IDO1 (0.47) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| SCHEMBL21294602 | 0.78 | IDO1 (0.47) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| Anthraquinone SCHEMBL27476680 | 0.76 | MEN1 (0.71) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| SCHEMBL27864640 | 0.75 | IDO1 (0.58) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| Dichlon SCHEMBL45723 | 0.73 | IDO1 (1.00) | IDO1DNMT1DNMT3LDNMT3AS100A4 | |
| SCHEMBL29563346 | 0.73 | RAB9A (0.68) | IDO1DNMT1DNMT3LDNMT3AS100A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116574034-A | Amino naphthoquinone derivative and its preparation and use in sterilization, weeding and algae killing | 青岛农业大学 | 2023-08-11 | — | — | CN | disclosed |