Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA4 | P22748 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL324772 | 0.88 | — | — | |
| SCHEMBL27281565 | 0.87 | ALDH1A1 (0.53) | ALDH1A1TSHRCA12CA1CA2 | |
| SCHEMBL417312 | 0.87 | ALDH1A1 (0.53) | ALDH1A1TSHRCA12CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL7763468 | 0.86 | — | — | |
| Water SCHEMBL7212356 | 0.86 | — | — | |
| Bromide SCHEMBL27445705 | 0.86 | — | — | |
| Butane SCHEMBL7206650 | 0.85 | ALDH1A1 (0.37) | ALDH1A1TSHRCA12CA1CA2 | |
| SCHEMBL9505491 | 0.85 | ALDH1A1 (0.37) | ALDH1A1TSHRCA12CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL721752 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRCA12CA1CA2 | |
| SCHEMBL28004818 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRCA12CA1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030129304-A1 | Mono-, di- or tribasic propellants for gun ammunition and method of making the same | NITROCHEMIE ASCHAU GMBH (DE) | 2003-07-10 | — | — | US | claimed |
| US-5578275-A | In-line sampling with continuous flushing for friction sensitive liquid nitrate ester compositions | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1996-11-26 | — | — | US | claimed |
| US-20030129304-A1 | Mono-, di- or tribasic propellants for gun ammunition and method of making the same | NITROCHEMIE ASCHAU GMBH (DE) | 2003-07-10 | — | — | US | disclosed |
| US-5578275-A | In-line sampling with continuous flushing for friction sensitive liquid nitrate ester compositions | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1996-11-26 | — | — | US | disclosed |