Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20861032 | 0.90 | CTSS (0.57) | CTSSOPRM1 | |
| SCHEMBL6654442 | 0.81 | CTSS (0.49) | CTSSCHRM2CHRM3OPRM1SIGMAR1 | |
| SCHEMBL20861268 | 0.81 | CTSS (0.57) | CTSS | |
| SCHEMBL17813969 | 0.81 | CTSS (0.58) | CTSS | |
| SCHEMBL6652795 | 0.80 | DRD2 (0.51) | CTSSCHRM2CHRM3OPRM1SIGMAR1 | |
| SCHEMBL6653716 | 0.79 | DRD2 (0.50) | CTSSCHRM2CHRM3OPRM1SIGMAR1 | |
| SCHEMBL6649677 | 0.79 | CTSS (0.47) | CTSSOPRM1SIGMAR1 | |
| SCHEMBL6653777 | 0.76 | CTSS (0.57) | CTSS | |
| SCHEMBL20861218 | 0.75 | CTSS (0.59) | CTSS | |
| SCHEMBL20861229 | 0.74 | CTSS (0.49) | CTSSOPRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016087352-A1 | NOVEL PIPERIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2016-06-09 | — | — | WO | disclosed |