Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6669115 | 0.87 | — | — | |
| Dl-Dithiothreitol SCHEMBL28388554 | 0.82 | LMNA (0.39) | LMNAALDH1A1TDP1NR1I2CYP1A2 | |
| Dl-Dithiothreitol SCHEMBL87345 | 0.82 | — | — | |
| Dl-Dithiothreitol SCHEMBL10601 | 0.82 | — | — | |
| Dl-Dithiothreitol SCHEMBL28874716 | 0.82 | LMNA (0.44) | LMNAALDH1A1TDP1NR1I2CYP1A2 | |
| Dl-Dithiothreitol SCHEMBL14496668 | 0.82 | — | — | |
| Dithiothreitol SCHEMBL538995 | 0.82 | — | — | |
| Dl-Dithiothreitol SCHEMBL21114400 | 0.82 | LMNA (0.44) | LMNAALDH1A1TDP1NR1I2CYP1A2 | |
| Dl-Dithiothreitol SCHEMBL21114401 | 0.82 | LMNA (0.44) | LMNAALDH1A1TDP1NR1I2CYP1A2 | |
| Dl-Dithiothreitol SCHEMBL17370231 | 0.82 | — | — |
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-109937234-A | The hyper-branched polyester that S-nitrosothiol mediates | 北卡罗来纳大学教堂山分校 | 2019-06-25 | — | — | CN | disclosed |