Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL696304 | 0.97 | FKBP1A (0.39) | OPRM1OPRD1OPRK1OGFRL1HSD11B1 | |
| SCHEMBL695720 | 0.92 | CTSS (0.37) | OPRM1OPRD1OPRK1OGFRL1HSD11B1 | |
| SCHEMBL696136 | 0.90 | AADAT (0.39) | OGFRL1HSD11B1CTSSAADATTSHR | |
| SCHEMBL694457 | 0.87 | AADAT (0.36) | OGFRL1HSD11B1CTSSAADATTSHR | |
| SCHEMBL696084 | 0.85 | P2RX7 (0.40) | CTSSFKBP1AEPHX2 | |
| SCHEMBL690481 | 0.82 | TSHR (0.36) | HSD11B1CTSSAADATTSHRMAPT | |
| SCHEMBL696114 | 0.82 | DRD2 (0.38) | CTSSFKBP1AMAPTMEN1ALDH1A1 | |
| SCHEMBL694848 | 0.81 | CTSS (0.36) | HSD11B1CTSSTSHRUSP2NPSR1 | |
| SCHEMBL696150 | 0.81 | FKBP1A (0.40) | CTSSTSHRUSP2NPSR1FKBP1A | |
| SCHEMBL695190 | 0.81 | HCRTR1 (0.39) | CTSSUSP2MAPTALDH1A1LMNA |
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-2421826-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010121918-A1 | PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-10-28 | — | — | WO | disclosed |