Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15431216 | 0.80 | UHRF1 (0.32) | BACE1 | |
| SCHEMBL16187977 | 0.73 | PTPN11 (0.33) | PTPN11 | |
| SCHEMBL16187943 | 0.73 | PTPN11 (0.33) | PTPN11 | |
| SCHEMBL4247572 | 0.72 | — | — | |
| SCHEMBL25234861 | 0.72 | CSNK1A1 (0.46) | — | |
| SCHEMBL4250286 | 0.68 | ATR (0.38) | EGLN1 | |
| SCHEMBL29479539 | 0.66 | — | — | |
| SCHEMBL191846 | 0.66 | — | — | |
| SCHEMBL5404663 | 0.66 | PTPN11 (0.31) | PTPN11 | |
| SCHEMBL21232346 | 0.66 | PGR (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008127399-A2 | AZAINDOLE DERIVATIVES AS CFTR MODULATORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-10-23 | — | — | WO | disclosed |