Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL10524815 | 0.78 | SERPINE1 (0.44) | CYP3A4TSHR | |
| Hydrochloric Acid SCHEMBL29044870 | 0.77 | ALDH1A1 (0.44) | CYP3A4 | |
| SCHEMBL9420545 | 0.77 | CYP3A4 (0.38) | CYP3A4TSHR | |
| SCHEMBL9420512 | 0.76 | CYP3A4 (0.35) | CYP3A4TSHR | |
| SCHEMBL9420463 | 0.76 | CYP3A4 (0.35) | CYP3A4TSHR | |
| SCHEMBL9420541 | 0.75 | CYP3A4 (0.32) | CYP3A4TSHR | |
| SCHEMBL9420491 | 0.73 | CYP3A4 (0.37) | CYP3A4TSHR | |
| Di(Hydroxyethyl)Ether SCHEMBL9395371 | 0.72 | CYP3A4 (0.69) | CYP3A4TSHR | |
| SCHEMBL9420625 | 0.72 | CYP3A4 (0.41) | CYP3A4TSHR | |
| SCHEMBL9420499 | 0.71 | SERPINE1 (0.49) | CYP3A4TSHR |
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-0328585-A1 | METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES | BIORESEARCH INC. (US) | 1989-08-23 | — | — | EP | disclosed |