Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.57 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.57 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.55 |
| ▸ | CTSL | P07711 | 3/20 | 0.53 |
| ▸ | PPARA | Q07869 | 3/20 | 0.53 |
| ▸ | CTSS | P25774 | 2/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.53 |
| ▸ | CTSK | P43235 | 5/20 | 0.52 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4342009 | 1.00 | SIRT2 (0.57) | SIRT2SIRT1FOLH1CTSLPPARA | |
| SCHEMBL9535457 | 0.90 | SIRT2 (0.59) | SIRT2SIRT1CTSLCTSSCTSK | |
| SCHEMBL9535447 | 0.90 | SIRT2 (0.59) | SIRT2SIRT1CTSLCTSSCTSK | |
| SCHEMBL19695767 | 0.88 | FOLH1 (0.56) | SIRT2SIRT1FOLH1PPARAPPARG | |
| SCHEMBL27147056 | 0.88 | FOLH1 (0.59) | SIRT2SIRT1FOLH1PPARAPPARG | |
| SCHEMBL27147057 | 0.88 | FOLH1 (0.59) | SIRT2SIRT1FOLH1PPARAPPARG | |
| SCHEMBL9351629 | 0.87 | FOLH1 (0.53) | SIRT2SIRT1FOLH1CTSLPPARA | |
| SCHEMBL7687140 | 0.87 | FOLH1 (0.55) | SIRT2SIRT1FOLH1PPARAPPARG | |
| SCHEMBL2985181 | 0.87 | SYK (0.56) | SIRT2SIRT1CTSLPPARACTSS | |
| SCHEMBL3193014 | 0.87 | SYK (0.56) | SIRT2SIRT1CTSLPPARACTSS |
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-2079683-A2 | DI-FLUORO CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS | ViroBay, Inc. (US) | 2009-07-22 | — | — | EP | disclosed |
| WO-2008042968-A2 | DI-FLUORO CONTAINING COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS | VIROBAY, INC. (US) | 2008-04-10 | — | — | WO | disclosed |