Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.53 |
| ▸ | MTOR | P42345 | 2/20 | 0.44 |
| ▸ | RPTOR | Q8N122 | 1/20 | 0.42 |
| ▸ | MLST8 | Q9BVC4 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | EP300 | Q09472 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | RIPK2 | O43353 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12410587 | 0.81 | CYP2A6 (0.56) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL1304053 | 0.80 | GAA (0.59) | MTORGRM4HTTGAA | |
| SCHEMBL12004826 | 0.79 | CYP2A6 (0.55) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL28194647 | 0.78 | CYP2A6 (0.53) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL2121774 | 0.78 | CYP2A6 (0.53) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL31132042 | 0.78 | CYP2A6 (0.53) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL3156531 | 0.78 | CYP2A6 (0.53) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL247216 | 0.78 | CYP2A6 (0.53) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL28195223 | 0.77 | CYP2A6 (0.49) | CYP2A6MTORRPTORMLST8CYP3A4 | |
| SCHEMBL12410440 | 0.76 | CYP2A6 (0.54) | CYP2A6MTORRPTORMLST8CYP3A4 |
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-2233493-A1 | Macrolides | Pfizer Products Inc. (US) | 2010-09-29 | — | — | EP | disclosed |