Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 9/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4691391 | 0.83 | SLC2A1 (0.36) | SLC2A1PAX8GRIN1GRIN2BPTPN1 | |
| SCHEMBL4689868 | 0.82 | SLC2A1 (0.41) | SLC2A1PAX8GRIN1GRIN2BPTPN1 | |
| SCHEMBL4691192 | 0.82 | GRIN1 (0.36) | SLC2A1PAX8GRIN1GRIN2BPTPN1 | |
| SCHEMBL4688933 | 0.80 | SLC2A1 (0.40) | SLC2A1PTPN1 | |
| Trifluoroacetic Acid SCHEMBL4691189 | 0.80 | SLC2A1 (0.39) | SLC2A1PAX8GRIN1GRIN2BPTPN1 | |
| Trifluoroacetic Acid SCHEMBL4691388 | 0.79 | SCN5A (0.38) | SLC2A1PAX8GRIN1GRIN2BPTPN1 | |
| Trifluoroacetic Acid SCHEMBL4690935 | 0.77 | SLC2A1 (0.39) | SLC2A1PAX8GRIN1GRIN2BPTPN1 | |
| SCHEMBL4688280 | 0.76 | SLC2A1 (0.42) | SLC2A1PAX8 | |
| SCHEMBL4687979 | 0.75 | DHFR (0.46) | SLC2A1PTPN1 | |
| SCHEMBL4710085 | 0.73 | GRIN2B (0.38) | GRIN1GRIN2BPTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1628979-B1 | DIAMINOPYRROLOQUINAZOLINES COMPOUNDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-03-19 | — | — | EP | disclosed |