Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL147530 | 0.87 | ALDH1A1 (0.43) | ALDH1A1TSHRTHRB | |
| SCHEMBL9126876 | 0.87 | ALDH1A1 (0.43) | ALDH1A1TSHRTHRB | |
| SCHEMBL145416 | 0.87 | ALDH1A1 (0.43) | ALDH1A1TSHRTHRB | |
| SCHEMBL7733580 | 0.87 | ALDH1A1 (0.43) | ALDH1A1TSHRTHRB | |
| SCHEMBL5334 | 0.84 | — | — | |
| SCHEMBL3795768 | 0.80 | THRB (0.39) | ALDH1A1TSHRTHRB | |
| SCHEMBL5337 | 0.74 | — | — | |
| SCHEMBL3794167 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRB | |
| Ethylene SCHEMBL1226494 | 0.73 | ALDH1A1 (0.50) | ALDH1A1TSHRTHRB | |
| Ethylene SCHEMBL11342315 | 0.73 | ALDH1A1 (0.50) | ALDH1A1TSHRTHRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-106029665-A | New cyclazines and their use as semiconductors | 巴斯夫欧洲公司 | 2016-10-12 | — | — | CN | disclosed |