Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 14/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL845092 | 0.92 | TP53 (0.41) | THRBTP53CFTR | |
| SCHEMBL13272447 | 0.84 | BCHE (0.31) | CFTR | |
| SCHEMBL873764 | 0.84 | TP53 (0.35) | THRBTP53CFTR | |
| SCHEMBL845096 | 0.83 | TP53 (0.40) | THRBTP53 | |
| SCHEMBL873619 | 0.76 | TP53 (0.34) | THRBTP53 | |
| SCHEMBL845370 | 0.69 | PIK3CA (0.37) | THRB | |
| SCHEMBL845518 | 0.66 | GAA (0.52) | TP53 | |
| SCHEMBL845354 | 0.61 | POLB (0.57) | TP53 | |
| SCHEMBL872930 | 0.60 | GAA (0.52) | — | |
| SCHEMBL17502615 | 0.59 | NPSR1 (0.60) | TP53 |
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-8143288-B2 | Inhibitors of HCV replication | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-03-27 | — | — | US | disclosed |