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 | |
|---|---|---|---|---|
| Water SCHEMBL28770543 | 0.84 | TSHR (0.31) | ALDH1A1TSHR | |
| Water SCHEMBL28143046 | 0.84 | TSHR (0.31) | ALDH1A1TSHR | |
| Thiocyanic Acid SCHEMBL757271 | 0.82 | CA1 (0.35) | ALDH1A1TSHR | |
| Thiocyanic Acid SCHEMBL757270 | 0.82 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL11780479 | 0.82 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| Cyanate SCHEMBL1073067 | 0.82 | CA1 (0.35) | ALDH1A1TSHR | |
| Cyanate SCHEMBL1073063 | 0.82 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| Water SCHEMBL27550759 | 0.81 | — | — | |
| SCHEMBL197824 | 0.80 | TSHR (0.33) | ALDH1A1TSHR | |
| Hydrogen Sulfide SCHEMBL28090943 | 0.80 | TSHR (0.33) | ALDH1A1TSHR |
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-4009328-A | Aminoglycoside 66-40C, method for its manufacture, method for its use as an intermediate in the preparation of known antibiotics and novel antibacterials | SCHERING CORPORATION (US) | 1977-02-22 | — | — | US | claimed |