Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.55 |
| ▸ | GAA | P10253 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | BLM | P54132 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 2/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | GMNN | O75496 | 1/20 | 0.53 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL28292868 | 0.85 | GSR (0.65) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL19937119 | 0.85 | GSR (0.76) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL7511206 | 0.83 | GSR (0.62) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL9124297 | 0.82 | GSR (0.61) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL11775795 | 0.82 | GSR (0.61) | GSRALDH1A1GAATSHRLMNA | |
| Hydrochloric Acid SCHEMBL8843405 | 0.82 | GSR (0.64) | GSRALDH1A1GAATSHRLMNA | |
| Hydrochloric Acid SCHEMBL8940929 | 0.80 | GSR (0.62) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL6660623 | 0.80 | GSR (0.69) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL16104894 | 0.80 | GSR (0.59) | GSRALDH1A1GAATSHRLMNA | |
| SCHEMBL8843759 | 0.79 | GSR (0.57) | GSRALDH1A1GAATSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006000294-A1 | NOVEL DIAZENIUMDIOLATE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | MERCK PATENT GMBH (DE) | 2006-01-05 | — | — | WO | disclosed |
| US-5393923-A | Enzyme inhibitor; treating arthritis and inflammation | WARNER-LAMBERT COMPANY (US) | 1995-02-28 | — | — | US | disclosed |
| US-5393923-A | Enzyme inhibitor; treating arthritis and inflammation | WARNER-LAMBERT COMPANY (US) | 1995-02-28 | — | — | US | disclosed |
| US-5393923-A | Enzyme inhibitor; treating arthritis and inflammation | WARNER-LAMBERT COMPANY (US) | 1995-02-28 | — | — | US | disclosed |
| US-5288896-A | 3,5-di-t-butyl-4-hydroxylphenylmethylhydroxylamines and their derivatives, pharmaceutical compositions, and methods of use therefor | WARNER-LAMBERT COMPANY (US) | 1994-02-22 | — | — | US | disclosed |
| US-5288896-A | 3,5-di-t-butyl-4-hydroxylphenylmethylhydroxylamines and their derivatives, pharmaceutical compositions, and methods of use therefor | WARNER-LAMBERT COMPANY (US) | 1994-02-22 | — | — | US | disclosed |
| US-5288896-A | 3,5-di-t-butyl-4-hydroxylphenylmethylhydroxylamines and their derivatives, pharmaceutical compositions, and methods of use therefor | WARNER-LAMBERT COMPANY (US) | 1994-02-22 | — | — | US | disclosed |