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 | |
|---|---|---|---|---|
| SCHEMBL980318 | 0.79 | ESR1 (0.34) | — | |
| SCHEMBL15063777 | 0.74 | NOS3 (0.38) | NOS3NOS2 | |
| SCHEMBL348335 | 0.74 | TRPA1 (0.31) | — | |
| SCHEMBL5485666 | 0.72 | — | — | |
| SCHEMBL8348913 | 0.72 | NOS3 (0.36) | NOS3NOS2 | |
| SCHEMBL9674011 | 0.71 | NOS3 (0.35) | NOS3NOS2 | |
| SCHEMBL10575456 | 0.68 | KCNH2 (0.36) | — | |
| SCHEMBL982496 | 0.68 | NOS2 (0.35) | NOS3NOS2 | |
| SCHEMBL983976 | 0.66 | ALDH1A1 (0.33) | NOS2 | |
| SCHEMBL983817 | 0.66 | LTA4H (0.38) | — |
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-4070383-A | COPPER COMPOUND-ANIONIC SURFACTANT-ALKALI METAL COMPOUND CATALYST SYSTEM | ICI AMERICAS INC. (US) | 1978-01-24 | — | — | US | disclosed |