Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | CTSS | P25774 | 2/20 | 0.54 |
| ▸ | CTSL | P07711 | 1/20 | 0.54 |
| ▸ | CTSB | P07858 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 1/20 | 0.54 |
| ▸ | ACE | P12821 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CTSD | P07339 | 2/20 | 0.51 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.50 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.50 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.50 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.50 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.50 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.50 |
| ▸ | SYK | P43405 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10062432 | 1.00 | KLK5 (0.57) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL9132420 | 0.90 | KLK5 (0.56) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL12245807 | 0.89 | KLK5 (0.57) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL13748497 | 0.87 | KLK5 (0.64) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL8283132 | 0.87 | KLK5 (0.64) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL13932829 | 0.87 | KLK5 (0.64) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL13328536 | 0.86 | KLK5 (0.66) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL12751287 | 0.86 | KLK5 (0.66) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL8486327 | 0.86 | KLK5 (0.63) | KLK5ATMCTSSCTSLCTSB | |
| SCHEMBL27796636 | 0.86 | KLK5 (0.63) | KLK5ATMCTSSCTSLCTSB |
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-2008055970-A2 | METHODS FOR THE PREPARATION OF HEXAHYDROFURO[2,3-B]FURAN-3-OL | TIBOTEC PHARMACEUTICALS LTD. (IE) | 2008-05-15 | — | — | WO | disclosed |