Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8486639 | 0.73 | GSK3A (0.36) | — | |
| SCHEMBL14603648 | 0.73 | — | — | |
| SCHEMBL3670371 | 0.72 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL1421150 | 0.70 | — | — | |
| SCHEMBL15416606 | 0.69 | — | — | |
| SCHEMBL856432 | 0.68 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL3542407 | 0.61 | NPSR1 (0.41) | ALDH1A1 | |
| SCHEMBL3672630 | 0.60 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL2321239 | 0.57 | IDO1 (0.39) | — | |
| SCHEMBL9851253 | 0.57 | GSK3A (0.40) | ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3356345-A1 | HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2018-08-08 | — | — | EP | disclosed |
| EP-2432779-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | Exelixis, Inc. (US) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010135524-A1 | BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES | EXELIXIS, INC. (US) | 2010-11-25 | — | — | WO | disclosed |