Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.48 |
| ▸ | NOS2 | P35228 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | GBA1 | P04062 | 1/20 | 0.37 |
| ▸ | PHGDH | O43175 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9595820 | 0.79 | NOS3 (0.36) | NOS3NOS2LCKHSD11B1MAPK1 | |
| SCHEMBL9588376 | 0.76 | KMT2A (0.52) | SMN1; SMN2ALDH1A1NPC1RAB9AGBA1 | |
| SCHEMBL11454904 | 0.73 | NOS3 (0.53) | NOS3NOS2LCKHSD11B1MAPK1 | |
| SCHEMBL9695791 | 0.69 | MEN1 (0.67) | MAPK1SMN1; SMN2ALDH1A1MAPTLMNA | |
| SCHEMBL10716502 | 0.68 | NOS3 (0.52) | NOS3NOS2LCKHSD11B1MAPK1 | |
| SCHEMBL943294 | 0.66 | NOS3 (1.00) | NOS3NOS2LCKMAPK1SMN1; SMN2 | |
| SCHEMBL8813027 | 0.66 | LCK (0.50) | NOS3NOS2LCKMAPK1SMN1; SMN2 | |
| SCHEMBL9081174 | 0.66 | LCK (0.50) | NOS3NOS2LCKMAPK1SMN1; SMN2 | |
| SCHEMBL8345724 | 0.66 | NOS3 (0.59) | NOS3NOS2LCKMAPK1SMN1; SMN2 | |
| Acetonitrile SCHEMBL8603147 | 0.66 | NOS3 (0.50) | NOS3NOS2HSD11B1ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0174832-A2 | Ethene derivatives | MAY & BAKER LIMITED (GB) | 1986-03-19 | — | — | EP | disclosed |