Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 5/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | SCN1A | P35498 | 5/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 5/20 | 0.52 |
| ▸ | SCN3A | Q9NY46 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Detanosal SCHEMBL2110875 | 0.87 | SCN1A (0.68) | TDP1TSHRCYP3A4ALDH1A1LMNA | |
| Detanosal SCHEMBL29163805 | 0.85 | SCN1A (0.66) | TDP1TSHRCYP3A4ALDH1A1LMNA | |
| Detanosal SCHEMBL30397539 | 0.85 | SCN1A (0.66) | TDP1TSHRCYP3A4ALDH1A1LMNA | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL29421150 | 0.85 | TSHR (0.80) | TDP1TSHRL3MBTL1CYP3A4MAPK1 | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL62565 | 0.85 | TSHR (0.80) | TDP1TSHRL3MBTL1CYP3A4MAPK1 | |
| SCHEMBL10710678 | 0.84 | ALDH1A1 (0.74) | TDP1TSHRL3MBTL1CYP3A4MAPK1 | |
| SCHEMBL8637734 | 0.84 | SCN1A (0.69) | TDP1TSHRL3MBTL1CYP3A4MAPK1 | |
| SCHEMBL2802336 | 0.84 | TDP1 (0.63) | TDP1TSHRL3MBTL1ALDH1A1LMNA | |
| 2-Hydroxybenzoic Acid Butyl Ester SCHEMBL8013639 | 0.83 | TSHR (0.77) | TDP1TSHRL3MBTL1CYP3A4MAPK1 | |
| SCHEMBL12095195 | 0.83 | TSHR (0.81) | TDP1TSHRL3MBTL1CYP3A4MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5292413-A | Catholyte for the Karl Fischer coulometric water determination | RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) | 1994-03-08 | — | — | US | disclosed |