Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3463417 | 0.84 | TSHR (0.44) | ALDH1A1THRBTSHR | |
| SCHEMBL28427167 | 0.82 | TSHR (0.47) | ALDH1A1TSHR | |
| SCHEMBL19019778 | 0.79 | ALDH1A1 (0.37) | ALDH1A1THRBTSHR | |
| SCHEMBL15219177 | 0.78 | TSHR (0.37) | ALDH1A1THRBTSHR | |
| SCHEMBL12941443 | 0.78 | TSHR (0.37) | ALDH1A1THRBTSHR | |
| SCHEMBL2276104 | 0.76 | ALDH1A1 (0.34) | ALDH1A1THRBTSHR | |
| SCHEMBL12941441 | 0.75 | TSHR (0.36) | ALDH1A1THRBTSHR | |
| SCHEMBL6924019 | 0.75 | ALDH1A1 (0.39) | ALDH1A1THRBTSHR | |
| SCHEMBL8475055 | 0.75 | ALOX15 (0.34) | — | |
| SCHEMBL1397630 | 0.74 | ALDH1A1 (0.35) | ALDH1A1THRBTSHR |
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-5691417-A | HYDROXYALKYL ACRYLATE INTERPOLYMERS, ISOCYANATES, STYRENE-FREE | HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-11-25 | — | — | US | disclosed |