Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2102798 | 1.00 | GAA (0.43) | GAAARSCN9AOPRM1OPRD1 | |
| SCHEMBL7968279 | 1.00 | GAA (0.43) | GAAARSCN9AOPRM1OPRD1 | |
| SCHEMBL7985048 | 1.00 | GAA (0.43) | GAAARSCN9AOPRM1OPRD1 | |
| SCHEMBL7982062 | 0.85 | GAA (0.58) | GAAARALDH1A1MAPTLMNA | |
| SCHEMBL31343587 | 0.81 | SMN1; SMN2 (0.53) | GAASCN9AOPRM1OPRD1OPRK1 | |
| SCHEMBL8404563 | 0.81 | MAPT (0.42) | ALDH1A1MAPTLMNANPSR1KMT2A | |
| SCHEMBL7981677 | 0.80 | CTSL (0.39) | ALDH1A1MAPTMMP2ANPEPLMNA | |
| SCHEMBL8084718 | 0.79 | SMN1; SMN2 (0.46) | GAAOPRM1OPRD1OPRK1OGFRL1 | |
| SCHEMBL7978138 | 0.79 | KMT2A (0.45) | ALDH1A1MAPTMMP2ANPEPKMT2A | |
| SCHEMBL2389846 | 0.78 | MAPT (0.53) | GAAALDH1A1MAPTMMP2ANPEP |
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 |