Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.58 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.57 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.57 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.56 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.53 |
| ▸ | LAP3 | P28838 | 1/20 | 0.53 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3296385 | 0.88 | ALDH1A1 (0.57) | LMNASLC6A2SLC6A3ALDH1A1L3MBTL1 | |
| SCHEMBL27923357 | 0.87 | ALDH1A1 (0.55) | LMNASLC6A2SLC6A3ALDH1A1L3MBTL1 | |
| SCHEMBL13686681 | 0.84 | PRKCA (0.66) | MAOBNR4A1NR4A2NR4A3FFAR1 | |
| Acetic Acid SCHEMBL27401419 | 0.83 | ALDH1A1 (0.61) | MAOBLMNASLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL9258815 | 0.83 | CA1 (0.47) | MAOBSLC6A2SLC6A3HDAC6ALDH1A1 | |
| Trimethylammonium SCHEMBL27550267 | 0.82 | ALDH1A1 (0.55) | LMNASLC6A2CYP2C19SLC6A3ALDH1A1 | |
| Dimethylamine SCHEMBL27585618 | 0.82 | KMT2A (0.55) | LMNASLC6A2SLC6A3ALDH1A1SMN1; SMN2 | |
| SCHEMBL8333346 | 0.82 | NR4A1 (0.66) | MAOBNR4A1NR4A2NR4A3FFAR1 | |
| Trifluoroacetic Acid SCHEMBL7420441 | 0.81 | FFAR1 (0.60) | MAOBNR4A1NR4A2NR4A3FFAR1 | |
| SCHEMBL2381708 | 0.81 | CES1 (0.69) | MAOBNR4A1NR4A2NR4A3FFAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1021411-A1 | BENZAMIDE DERIVATIVES AS THROMBIN INHIBITORS | GLAXO GROUP LIMITED (GB) | 2000-07-26 | — | — | EP | disclosed |
| WO-1997022589-A1 | BENZAMIDE DERIVATIVES AS THROMBIN INHIBITORS | GLAXO GROUP LIMITED (GB) | 1997-06-26 | — | — | WO | disclosed |