Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Nitroglycerin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL961470 | 0.98 | PTGS2 (0.34) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL15421 | 0.87 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL920644 | 0.87 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL3640987 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL28723109 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL28118295 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL10424193 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL3640991 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL7752031 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 | |
| Nitroglycerin SCHEMBL7752036 | 0.85 | PTGS2 (0.40) | PTGS2PTGS1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117388425-A | Method for rapidly testing burning rate of NEPE propellant | 西安近代化学研究所 | 2024-01-12 | — | — | CN | claimed |
| CN-112500253-B | Temperature-sensitive time-varying high-energy solid propellant | 湖北航天化学技术研究所 | 2022-04-12 | — | — | CN | claimed |
| CN-112500253-A | Temperature-sensitive time-varying high-energy solid propellant | 湖北航天化学技术研究所 | 2021-03-16 | — | — | CN | claimed |
| CN-118108555-A | Coaxial 3D printing method for improving burning speed of solid propellant and propellant | 湖北航天化学技术研究所 | 2024-05-31 | — | — | CN | disclosed |
| CN-117388425-A | Method for rapidly testing burning rate of NEPE propellant | 西安近代化学研究所 | 2024-01-12 | — | — | CN | disclosed |
| CN-112500253-B | Temperature-sensitive time-varying high-energy solid propellant | 湖北航天化学技术研究所 | 2022-04-12 | — | — | CN | disclosed |
| CN-112500253-A | Temperature-sensitive time-varying high-energy solid propellant | 湖北航天化学技术研究所 | 2021-03-16 | — | — | CN | disclosed |