Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.43 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | PLAT | P00750 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CHEK2 | O96017 | 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 | |
|---|---|---|---|---|
| SCHEMBL1950261 | 0.87 | PTPN11 (0.42) | CA1CA2PARP10PARP1PARP2 | |
| SCHEMBL242923 | 0.86 | PTPN11 (0.46) | CA1CA2PARP10PARP1PARP2 | |
| SCHEMBL1830075 | 0.85 | SMN1; SMN2 (0.43) | SMN1; SMN2MAPTKDM4EPOLBMEN1 | |
| SCHEMBL245309 | 0.83 | SMN1; SMN2 (0.41) | SMN1; SMN2MAPKAPK2PLAUPLATCHEK2 | |
| SCHEMBL249222 | 0.83 | SMN1; SMN2 (0.41) | CA1CA2PARP10PARP1PARP2 | |
| SCHEMBL242932 | 0.82 | SMN1; SMN2 (0.41) | CA1CA2PARP10PARP1PARP2 | |
| SCHEMBL244774 | 0.82 | SMN1; SMN2 (0.41) | CA1CA2PARP10PARP1PARP2 | |
| SCHEMBL243931 | 0.82 | POLB (0.40) | CA1CA2PARP10PARP1PARP2 | |
| SCHEMBL12540744 | 0.80 | MAPT (0.45) | SMN1; SMN2MAPKAPK2MAPTPLAUPLAT | |
| SCHEMBL243838 | 0.79 | MAPKAPK2 (0.45) | MAPKAPK2MAP4K4PLAUPLATPTPN11 |
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-2315590-A1 | PYRROLE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE | N30 Pharmaceuticals, LLC (US) | 2011-05-04 | — | — | EP | disclosed |
| WO-2010019909-A1 | PYRROLE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE | N30 PHARMACEUTICALS, LLC (US) | 2010-02-18 | — | — | WO | disclosed |