Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 17/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 15/20 | 0.46 |
| ▸ | PTGES | O14684 | 8/20 | 0.45 |
| ▸ | PPARG | P37231 | 11/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19476060 | 0.91 | MAOB (0.39) | PSEN1ALOX5 | |
| SCHEMBL19476245 | 0.90 | PSEN1 (0.42) | PSEN1ALOX5PTGESPPARG | |
| SCHEMBL17469676 | 0.84 | CES2 (0.40) | — | |
| SCHEMBL19476034 | 0.80 | CES2 (0.38) | — | |
| SCHEMBL19175928 | 0.79 | CA1 (0.45) | PPARG | |
| SCHEMBL19476243 | 0.76 | CYSLTR2 (0.37) | PPARG | |
| SCHEMBL19476035 | 0.75 | CA1 (0.39) | — | |
| SCHEMBL19476057 | 0.74 | MAOB (0.48) | — | |
| SCHEMBL19476241 | 0.73 | CA1 (0.39) | — | |
| SCHEMBL19168589 | 0.70 | NPC1 (0.40) | — |
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-2017180248-A1 | ENANTIOENRICHED VIRIDICATUMTOXIN B ANALOGS | WILLIAM MARSH RICE UNIVERSITY (US) | 2017-10-19 | — | — | WO | disclosed |