Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 4/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | IGFBP3 | P17936 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | LDHB | P07195 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.35 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.34 |
| ▸ | GLRB | P48167 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL31214299 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL6582434 | 0.84 | ALDH1A1 (0.44) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL6217742 | 0.83 | ALDH1A1 (0.61) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL30586203 | 0.83 | ALDH1A1 (0.61) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL23277298 | 0.81 | ALDH1A1 (0.42) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL2097253 | 0.79 | POLB (0.45) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL4698528 | 0.76 | SMN1; SMN2 (0.66) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL10864783 | 0.76 | ALDH1A1 (0.50) | ALDH1A1MAPK1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL31140481 | 0.76 | MAPT (0.36) | SMN1; SMN2MAPTDHODHPOLBMEN1 | |
| SCHEMBL4369984 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPK1SMN1; SMN2MAPTDHODH |
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 |
|---|---|---|---|---|---|---|---|
| EP-0526732-A2 | Processes for the preparation of heterocyclic thiocarbamates | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-02-10 | — | — | EP | disclosed |