Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7790158 | 0.78 | CCR6 (0.42) | OPRM1OPRD1OPRK1CCR6PAX8 | |
| SCHEMBL6181959 | 0.74 | CTSL (0.40) | OPRM1OPRD1OPRK1CCR6PAX8 | |
| SCHEMBL7799705 | 0.74 | CCR6 (0.38) | OPRM1OPRD1OPRK1ABCB1CCR6 | |
| SCHEMBL7800958 | 0.73 | OPRM1 (0.41) | OPRM1OPRD1OPRK1HDAC1HDAC6 | |
| SCHEMBL6183141 | 0.73 | ALOX5 (0.43) | ABCB1CCR6PAX8CTSKCTSL | |
| SCHEMBL6183149 | 0.72 | CTSS (0.44) | CTSKCTSLCTSBCTSSALDH1A1 | |
| SCHEMBL7137505 | 0.71 | SMN1; SMN2 (0.41) | CTSKCTSLCTSB | |
| SCHEMBL6183588 | 0.70 | CTSS (0.43) | CCR6PAX8CTSKCTSLCTSB | |
| SCHEMBL6183195 | 0.70 | CTSS (0.42) | CTSKCTSLCTSBCTSSALDH1A1 | |
| SCHEMBL12130679 | 0.70 | KMT2A (0.50) | ABCB1CCR6PAX8LMNACTSB |
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-1159260-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000055124-A2 | NOVEL COMPOUNDS AND COMPOSITIONS AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |