Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL7558656 | 0.85 | ACHE (0.39) | — | |
| SCHEMBL6682709 | 0.84 | GABRA1 (0.38) | TP53 | |
| SCHEMBL5390055 | 0.80 | ALDH1A1 (0.40) | — | |
| SCHEMBL7765785 | 0.80 | CA1 (0.46) | TP53 | |
| SCHEMBL28241024 | 0.80 | PNMT (0.39) | — | |
| SCHEMBL28240930 | 0.79 | LIPG (0.42) | — | |
| SCHEMBL28226718 | 0.77 | TRPA1 (0.37) | TP53 | |
| SCHEMBL30616086 | 0.77 | TP53 (0.36) | TP53 | |
| SCHEMBL22288227 | 0.76 | ALDH1A1 (0.36) | SIGMAR1 | |
| SCHEMBL940829 | 0.76 | TP53 (0.38) | TP53SIGMAR1 |
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-6194593-B1 | USEFUL AS LIGAND FOR AN ASYMMETRIC CATALYST FOR USE IN ASYMMETRICAL HYDROGENATION | NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) | 2001-02-27 | — | — | US | disclosed |