Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.49 |
| ▸ | CCR6 | P51684 | 2/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 13/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 9/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1835672 | 0.84 | MAP3K12 (0.50) | MAP3K12HCRTR1HCRTR2KMT2A | |
| SCHEMBL1835677 | 0.82 | KDM4E (0.52) | MAP3K12HCRTR1HCRTR2 | |
| SCHEMBL1141302 | 0.81 | MAP3K12 (0.51) | MAP3K12CCR6HCRTR1HCRTR2 | |
| SCHEMBL1141304 | 0.81 | MAP3K12 (0.51) | MAP3K12CCR6HCRTR1HCRTR2 | |
| SCHEMBL1838879 | 0.79 | EGFR (0.43) | HCRTR1KMT2A | |
| SCHEMBL20144723 | 0.76 | HCRTR1 (0.70) | HCRTR1HCRTR2 | |
| SCHEMBL18697754 | 0.76 | HCRTR1 (0.70) | HCRTR1HCRTR2 | |
| SCHEMBL20145041 | 0.76 | HCRTR1 (0.64) | HCRTR1HCRTR2 | |
| SCHEMBL20144969 | 0.76 | HCRTR1 (0.64) | HCRTR1HCRTR2 | |
| SCHEMBL20145008 | 0.75 | HCRTR1 (0.53) | MAP3K12HCRTR1HCRTR2 |
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-2318367-A1 | PIPERIDINE AND PYRROLIDINE COMPOUNDS | Actelion Pharmaceuticals Ltd. (CH) | 2011-05-11 | — | — | EP | disclosed |