Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 2/20 | 0.71 |
| ▸ | BLM | P54132 | 1/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 4/20 | 0.38 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9417552 | 0.95 | PLA2G2A (0.62) | PLA2G2ABLMTSHRTP53CNR1 | |
| SCHEMBL9171311 | 0.93 | PLA2G2A (0.82) | PLA2G2ABLMTSHRTP53PLA2G4B | |
| SCHEMBL9171634 | 0.92 | PLA2G2A (0.85) | PLA2G2ABLMTSHRTP53CNR1 | |
| SCHEMBL9167792 | 0.87 | PLA2G2A (0.73) | PLA2G2ABLMCNR1CNR2 | |
| SCHEMBL9168532 | 0.87 | PLA2G2A (0.74) | PLA2G2ABLMTSHRTP53CNR1 | |
| SCHEMBL9171087 | 0.85 | PLA2G2A (0.81) | PLA2G2ABLMCNR1CNR2 | |
| SCHEMBL9162996 | 0.84 | PLA2G2A (1.00) | PLA2G2ABLMTSHRTP53CNR1 | |
| SCHEMBL9173041 | 0.84 | PLA2G2A (1.00) | PLA2G2ABLMTSHRTP53CNR1 | |
| SCHEMBL9168811 | 0.84 | PLA2G2A (1.00) | PLA2G2ABLMTSHRTP53CNR1 | |
| SCHEMBL9171657 | 0.84 | PLA2G2A (1.00) | PLA2G2ABLMTSHRTP53CNR1 |
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-5446189-A | Diester intermediates for diacid enzyme inhibitor | HOFFMANN-LA ROCHE INC. (US) | 1995-08-29 | — | — | US | disclosed |