Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 16/20 | 0.77 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18628367 | 0.90 | SMO (0.88) | SMOPAX8NPSR1 | |
| SCHEMBL18628368 | 0.90 | SMO (0.88) | SMOPAX8NPSR1 | |
| SCHEMBL2160744 | 0.87 | SMO (1.00) | SMO | |
| SCHEMBL2160629 | 0.87 | SMO (1.00) | SMO | |
| SCHEMBL2160741 | 0.87 | SMO (1.00) | SMO | |
| SCHEMBL18628460 | 0.87 | SMO (0.82) | SMOPAX8 | |
| SCHEMBL18628497 | 0.85 | SMO (0.77) | SMOPAX8MAPK1 | |
| SCHEMBL2160672 | 0.83 | SMO (0.88) | SMO | |
| SCHEMBL2160674 | 0.83 | SMO (0.88) | SMO | |
| SCHEMBL18628438 | 0.82 | SMO (0.80) | SMONPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2334683-B1 | SATURATED BICYCLIC HETEROCYCLIC DERIVATIVES AS SMO ANTAGONISTS | MSD ITALIA SRL (IT) | 2017-03-22 | — | — | EP | disclosed |