Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.42 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PRCP | P42785 | 1/20 | 0.40 |
| ▸ | MC4R | P32245 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CDC42 | P60953 | 1/20 | 0.40 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.40 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.40 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3346373 | 0.87 | KCNH2 (0.57) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL3346539 | 0.87 | KCNH2 (0.57) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL13365124 | 0.84 | CYP3A4 (0.55) | KCNH2ROCK2KCNQ3KCNQ2CYP3A4 | |
| SCHEMBL3347137 | 0.84 | CYP3A4 (0.55) | KCNH2ROCK2KCNQ3KCNQ2CYP3A4 | |
| SCHEMBL13365065 | 0.81 | KCNH2 (0.52) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL3353124 | 0.81 | KCNH2 (0.52) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL3353036 | 0.81 | KCNH2 (0.52) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL13365099 | 0.81 | KCNH2 (0.52) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL13364977 | 0.81 | KCNH2 (0.60) | KCNH2ROCK2KCNQ3KCNQ2GAA | |
| SCHEMBL3347919 | 0.81 | KCNH2 (0.60) | KCNH2ROCK2KCNQ3KCNQ2GAA |
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-2010059922-A1 | PYRROLIDINE CARBOXAMIDE COMPOUNDS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2010-05-27 | — | — | WO | claimed |