Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1080642 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1052050 | 0.90 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1 | |
| SCHEMBL9107576 | 0.87 | ALDH1A1 (0.48) | ALDH1A1 | |
| SCHEMBL21561557 | 0.82 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1 | |
| SCHEMBL11345601 | 0.82 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1 | |
| SCHEMBL12778789 | 0.81 | TSHR (0.41) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1698305 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TDP1 | |
| SCHEMBL5915771 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TDP1 | |
| SCHEMBL37987 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TSHR | |
| SCHEMBL9720193 | 0.79 | ALDH1A1 (0.59) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120138206-A1 | ADHESIVES AND SEALANTS CONTAINING CYCLOHEXANE POLYCARBOXYLIC ACID DERIVATIVES | BASF SE (DE) | 2012-06-07 | — | — | US | disclosed |