Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1172467 | 0.82 | CYP1A2 (0.40) | CYP1A2CYP2C9MAPT | |
| SCHEMBL15776050 | 0.82 | MAPT (0.35) | MEN1LMNAMAPTKMT2A | |
| SCHEMBL6131347 | 0.80 | CYP1A2 (0.39) | CYP1A2CYP2C9MAPT | |
| Potassium Ion SCHEMBL6131368 | 0.80 | CYP1A2 (0.39) | CYP1A2CYP2C9MAPT | |
| Ammonia Solution, Strong SCHEMBL9727420 | 0.80 | CYP1A2 (0.39) | CYP1A2CYP2C9MAPT | |
| Potassium SCHEMBL6131371 | 0.80 | CYP1A2 (0.39) | CYP1A2CYP2C9MAPT | |
| SCHEMBL11318233 | 0.80 | CYP1A2 (0.53) | CYP1A2CYP2C9MEN1LMNAMAPT | |
| SCHEMBL18284832 | 0.69 | LMNA (0.59) | CYP1A2MEN1LMNAMAPTKMT2A | |
| Ammonia Solution, Strong SCHEMBL9727425 | 0.67 | CYP1A2 (0.36) | CYP1A2CYP2C9 | |
| SCHEMBL6131370 | 0.67 | CYP1A2 (0.36) | CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104649984-B | 1,1 ' two (together with dinitro methyl) 3,3 ' dinitros 5,5 ' join the double hydroxylamine salts of 1,2,4 triazoles | 西安近代化学研究所 | 2018-04-20 | — | — | CN | disclosed |