Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 12/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | FASN | P49327 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6063377 | 0.85 | ALDH1A1 (0.44) | PTPN2PTPN1 | |
| SCHEMBL6062878 | 0.85 | ALDH1A1 (0.44) | PTPN2PTPN1 | |
| SCHEMBL6633244 | 0.84 | CTSS (0.35) | PTPN2PTPN1CTSSCYP3A4CYP2C9 | |
| SCHEMBL6700654 | 0.84 | CTSS (0.35) | PTPN2PTPN1CTSSCYP3A4CYP2C9 | |
| SCHEMBL6700659 | 0.84 | CTSS (0.35) | PTPN2PTPN1CTSSCYP3A4CYP2C9 | |
| SCHEMBL6630977 | 0.80 | CTSS (0.34) | PTPN2PTPN1CTSSCYP3A4CYP2C9 | |
| SCHEMBL6630976 | 0.80 | CTSS (0.34) | PTPN2PTPN1CTSSCYP3A4CYP2C9 | |
| SCHEMBL6630981 | 0.80 | CTSS (0.34) | PTPN2PTPN1CTSSCYP3A4CYP2C9 | |
| SCHEMBL6627857 | 0.79 | ACACB (0.36) | CTSSCYP3A4RAB9AL3MBTL1 | |
| SCHEMBL6628343 | 0.79 | ACACB (0.36) | CTSSCYP3A4RAB9AL3MBTL1 |
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-1397340-A2 | CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2004-03-17 | — | — | EP | disclosed |
| WO-2002098850-A2 | CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-12-12 | — | — | WO | disclosed |