Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | LTA4H | P09960 | 2/20 | 0.53 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.52 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.52 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.52 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.52 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.48 |
| ▸ | TLR4 | O00206 | 1/20 | 0.48 |
| ▸ | TLR2 | O60603 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8778604 | 0.96 | TSHR (0.62) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL7476889 | 0.94 | TSHR (0.54) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL8778627 | 0.93 | TSHR (0.62) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL8778518 | 0.91 | TSHR (0.65) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL8778556 | 0.89 | TSHR (0.62) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL4397448 | 0.88 | TSHR (0.63) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL8778500 | 0.87 | TSHR (0.65) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL11663051 | 0.86 | TSHR (0.72) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| 1-Butyloxy-3-Propoxybenzene SCHEMBL3390925 | 0.84 | TSHR (0.59) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 | |
| SCHEMBL3905859 | 0.84 | TSHR (0.76) | TSHRLTA4HGPBAR1PLA2G4BCYSLTR2 |
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 |