Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.47 |
| ▸ | PPARA | Q07869 | 4/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.46 |
| ▸ | PPARD | Q03181 | 2/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 4/20 | 0.43 |
| ▸ | CTSK | P43235 | 3/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6576260 | 0.91 | KLK5 (0.45) | KLK5PPARAPPARGMTNR1AMTNR1B | |
| SCHEMBL6574905 | 0.91 | KLK5 (0.45) | KLK5PPARAPPARGMTNR1AMTNR1B | |
| SCHEMBL6579018 | 0.91 | KLK5 (0.45) | KLK5PPARAPPARGMTNR1AMTNR1B | |
| SCHEMBL7433466 | 0.90 | BACE1 (0.48) | KLK5MTNR1AMTNR1B | |
| SCHEMBL15866036 | 0.86 | PPARA (0.48) | KLK5PPARAPPARGMTNR1AMTNR1B | |
| SCHEMBL9404273 | 0.82 | MTNR1A (0.64) | PPARAPPARGMTNR1AMTNR1BPPARD | |
| SCHEMBL8910228 | 0.82 | MTNR1A (0.64) | PPARAPPARGMTNR1AMTNR1BPPARD | |
| SCHEMBL5468323 | 0.82 | PPARA (0.50) | KLK5PPARAPPARGPPARDCTSS | |
| SCHEMBL14447760 | 0.82 | PPARA (0.50) | KLK5PPARAPPARGPPARDCTSS | |
| SCHEMBL4671732 | 0.81 | PPARA (0.64) | PPARAPPARGMTNR1AMTNR1BPPARD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0972760-B1 | PROCESS FOR THE PURIFICATION OR ISOLATION OF (2S, 3R)-1-HALO-2-HYDROXY-3-(PROTECTED AMINO)-4-PHENYLTHIOBUTANES OR OPTICAL ANTIPODES THEREOF | KANEKA CORP (JP) | 2004-09-22 | — | — | EP | disclosed |
| US-6107511-A | Process for the purification or isolation of (2S,3R)-1-halo-2-hydroxy-3-(protected amino)4-phenylthiobutanes or optical antipodes thereof | KANEKA CORPORATION (JP) | 2000-08-22 | — | — | US | disclosed |
| EP-0972760-A1 | PROCESS FOR THE PURIFICATION OR ISOLATION OF (2S, 3R)-1-HALO-2-HYDROXY-3-(PROTECTED AMINO)-4-PHENYLTHIOBUTANES OR OPTICAL ANTIPODES THEREOF | KANEKA CORPORATION (JP) | 2000-01-19 | — | — | EP | disclosed |