Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA9 | Q16790 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11332578 | 0.89 | HTR6 (0.51) | CA2CA1CA9CA12CA7 | |
| SCHEMBL8059962 | 0.82 | GAA (0.60) | CA2CA1CA9CA12CA7 | |
| SCHEMBL11319748 | 0.81 | GAA (0.40) | CA2CA1CA9CA12CA7 | |
| SCHEMBL11320787 | 0.81 | CA1 (0.40) | CA2CA1CA9CA12CA7 | |
| SCHEMBL1925949 | 0.80 | CA2 (0.45) | CA2CA1CA9CA12CA7 | |
| SCHEMBL11330242 | 0.80 | LMNA (0.56) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL11326018 | 0.79 | CA1 (0.38) | CA2CA1CA9CA12CA7 | |
| SCHEMBL9634824 | 0.79 | GAA (0.56) | CA2CA1GAARAPGEF4ALDH1A1 | |
| SCHEMBL14060214 | 0.79 | CA2 (0.57) | CA2CA1CA9CA12CA7 | |
| SCHEMBL8964467 | 0.78 | GAA (0.60) | CA2CA1CA9CA12CA7 |
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-5034534-A | Catalytic carbonylation of aryl halides with palladium catalyst and phosphine ligands, cyclization to form saccharin | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-07-23 | — | — | US | disclosed |