Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | DRD3 | P35462 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28672526 | 0.77 | ALOX5 (0.46) | PTGS2NISCHALOX5CYP19A1ALDH1A1 | |
| SCHEMBL11230728 | 0.77 | LMNA (0.44) | PTGS2NISCHALOX5KDM4EMEN1 | |
| SCHEMBL571115 | 0.77 | MAPT (0.45) | NISCHALOX5CYP19A1DRD2KDM4E | |
| SCHEMBL29518399 | 0.76 | NISCH (0.53) | CYP11B1CYP11B2PTGS2NISCHALOX5 | |
| SCHEMBL230113 | 0.76 | NISCH (0.53) | CYP11B1CYP11B2PTGS2NISCHALOX5 | |
| SCHEMBL31191954 | 0.73 | PTGS2 (0.50) | PTGS2ALOX5CA12CA9P2RY6 | |
| SCHEMBL31191990 | 0.72 | CA12 (0.40) | PTGS2TRPA1CA12CA9P2RY6 | |
| SCHEMBL616344 | 0.69 | RARA (0.46) | TRPA1NISCHALOX5ALDH1A1MAPT | |
| SCHEMBL5208747 | 0.69 | PTGS2 (0.48) | PTGS2ALOX5CA12CA9P2RY6 | |
| SCHEMBL28663649 | 0.67 | MEN1 (0.50) | KDM4EMEN1ALDH1A1POLBMAPT |
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-4341792-A | ANTIDIABETIC AND CARDIOTONIC AGENTS | PFIZER INC. (US) | 1982-07-27 | — | — | US | disclosed |