Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL26606264 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TDP1 | |
| SCHEMBL29009257 | 0.80 | LMNA (0.48) | ALDH1A1TDP1 | |
| SCHEMBL16600360 | 0.80 | SLC22A6 (0.43) | TDP1 | |
| SCHEMBL15704275 | 0.78 | TSHR (0.47) | ALDH1A1TDP1TSHR | |
| SCHEMBL632560 | 0.78 | TSHR (0.47) | ALDH1A1TDP1TSHR | |
| SCHEMBL16280839 | 0.78 | TSHR (0.47) | ALDH1A1TDP1TSHR | |
| SCHEMBL19668472 | 0.77 | ALDH1A1 (0.50) | ALDH1A1TDP1 | |
| SCHEMBL7940094 | 0.77 | ALDH1A1 (0.43) | ALDH1A1TDP1TSHR | |
| SCHEMBL11128155 | 0.73 | TDP1 (0.57) | ALDH1A1TDP1 | |
| SCHEMBL10994553 | 0.73 | ALDH1A1 (0.40) | ALDH1A1TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3377219-A1 | CATALYST SYSTEM AND PROCESS FOR THE PRODUCTION OF GLYCOLS | SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B.V. (NL) | 2018-09-26 | — | — | EP | disclosed |
| EP-3377216-A1 | CATALYST SYSTEM AND PROCESS FOR THE PRODUCTION OF GLYCOLS | Shell Internationale Research Maatschappij B.V. (NL) | 2018-09-26 | — | — | EP | disclosed |