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 | |
|---|---|---|---|---|
| SCHEMBL29026685 | 0.86 | ACE2 (0.42) | ALDH1A1 | |
| SCHEMBL11055222 | 0.85 | ALDH1A1 (0.34) | TSHRALDH1A1 | |
| SCHEMBL11058962 | 0.81 | TSHR (0.36) | TSHRALDH1A1 | |
| SCHEMBL287823 | 0.78 | — | — | |
| SCHEMBL7572619 | 0.77 | ALDH1A1 (0.34) | ALDH1A1 | |
| Hexadecane SCHEMBL28233258 | 0.76 | ALDH1A1 (0.42) | TSHRALDH1A1 | |
| SCHEMBL324772 | 0.74 | — | — | |
| Butane SCHEMBL7083181 | 0.74 | ALDH1A1 (0.43) | TSHRALDH1A1 | |
| SCHEMBL18243623 | 0.74 | — | — | |
| SCHEMBL10489572 | 0.73 | ALDH1A1 (0.32) | 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-4448587-A | ALKYL NITRATES AND ALKOXYALKYL NITRATES AS ADDITIVES | ETHYL CORPORATION (US) | 1984-05-15 | — | — | US | disclosed |