Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.38 |
| ▸ | MAS1 | P04201 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.33 |
| ▸ | EDNRA | P25101 | 2/20 | 0.33 |
| ▸ | EDNRB | P24530 | 1/20 | 0.33 |
| ▸ | FBP1 | P09467 | 1/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5175143 | 0.90 | PTGES2 (0.39) | PTGES2VDRMEN1CYP1A2CYP2D6 | |
| SCHEMBL5173529 | 0.88 | ALOX5AP (0.43) | — | |
| SCHEMBL7616129 | 0.87 | PTGES2 (0.33) | PTGES2MAS1FBP1VDRMEN1 | |
| SCHEMBL5173993 | 0.80 | TRPV1 (0.36) | — | |
| SCHEMBL7609717 | 0.80 | AGTR1 (0.38) | AGTR1AGTR2 | |
| SCHEMBL5173937 | 0.79 | ALOX5AP (0.41) | — | |
| SCHEMBL7616191 | 0.78 | TP53 (0.37) | PTGES2MAS1VDRMEN1KMT2A | |
| SCHEMBL6807452 | 0.78 | MAS1 (0.34) | MAS1AGTR1AGTR2 | |
| SCHEMBL7616527 | 0.77 | MAS1 (0.43) | MAS1EDNRAMEN1KMT2A | |
| SCHEMBL7609835 | 0.77 | GP6 (0.42) | MAS1AGTR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6335451-B1 | ANTIARRYTHMIA AGENTS, ANTIPROLIFERATIVE AGENTS | HOECHST AKTIENGESELLSCHAFT (DE) | 2002-01-01 | — | — | US | disclosed |