Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.52 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 5/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1046516 | 1.00 | NOS1 (0.52) | NOS1LTA4HMAOBPPARAMRGPRX4 | |
| SCHEMBL1047648 | 0.98 | NOS1 (0.51) | NOS1LTA4HMAOBPPARAMRGPRX4 | |
| SCHEMBL1046760 | 0.92 | NOS1 (0.50) | NOS1LTA4HMAOBPPARACHRNB2 | |
| SCHEMBL1044973 | 0.86 | LTA4H (0.50) | NOS1LTA4HMAOBPPARAMRGPRX4 | |
| SCHEMBL4104367 | 0.81 | NOS1 (0.52) | NOS1LTA4HMAOBPPARAMRGPRX4 | |
| SCHEMBL6750419 | 0.81 | NOS1 (0.52) | NOS1LTA4HMAOBPPARAMRGPRX4 | |
| SCHEMBL17233207 | 0.81 | NOS1 (0.52) | NOS1LTA4HMAOBPPARAMRGPRX4 | |
| SCHEMBL2088711 | 0.81 | NOS1 (0.52) | NOS1LTA4HMAOBPPARAALDH1A1 | |
| SCHEMBL1010083 | 0.81 | NOS1 (0.52) | NOS1LTA4HMAOBPPARAALDH1A1 | |
| SCHEMBL17518295 | 0.81 | NR5A1 (0.59) | NOS1LTA4HCHRNB2CHRNB4CHRNA3 |
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-0574355-B1 | Phosphinyloxy propanaminium inner salt derivatives | CIBA GEIGY AG (CH) | 1997-08-13 | — | — | EP | claimed |
| EP-0574355-A1 | Phosphinyloxy propanaminium inner salt derivatives | SANDOZ LTD. (CH) | 1993-12-15 | — | — | EP | claimed |