Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.63 |
| ▸ | CTSS | P25774 | 4/20 | 0.60 |
| ▸ | CTSK | P43235 | 3/20 | 0.60 |
| ▸ | CTSL | P07711 | 1/20 | 0.60 |
| ▸ | CTSB | P07858 | 1/20 | 0.60 |
| ▸ | ACE | P12821 | 1/20 | 0.57 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.56 |
| ▸ | PPARA | Q07869 | 2/20 | 0.52 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | AKT1 | P31749 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9299789 | 1.00 | ATM (0.63) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL29142688 | 0.91 | CTSS (0.65) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL29142687 | 0.91 | CTSS (0.65) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL6445261 | 0.85 | KLK5 (0.63) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL7270592 | 0.85 | KLK5 (0.63) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL6444857 | 0.85 | KLK5 (0.63) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL8532202 | 0.85 | KLK5 (0.63) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL9848360 | 0.85 | KLK5 (0.63) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL22042132 | 0.85 | CTSK (0.62) | ATMCTSSCTSKCTSLCTSB | |
| SCHEMBL6445320 | 0.85 | KLK5 (0.63) | ATMCTSSCTSKCTSLCTSB |
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-2010023322-A1 | PROCESS FOR THE PREPARATION OF (3R,3AS,6AR)-HEXAHYDROFURO [2,3-B] FURAN-3-YL (1S,2R)-3-[[(4-AMINOPHENYL) SULFONYL] (ISOBUTYL) AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE | TIBOTEC PHARMACEUTICALS (IE) | 2010-03-04 | — | — | WO | disclosed |