Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.53 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.48 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13365124 | 1.00 | CYP3A4 (0.55) | CYP3A4KCNQ3KCNQ2KCNH2KCNQ4 | |
| SCHEMBL3346230 | 0.88 | KCNQ3 (0.66) | CYP3A4KCNQ3KCNQ2KCNH2KCNQ4 | |
| SCHEMBL13365060 | 0.87 | KCNH2 (0.52) | CYP3A4KCNQ3KCNQ2KCNH2KCNQ4 | |
| SCHEMBL3346905 | 0.84 | KCNH2 (0.49) | CYP3A4KCNQ3KCNQ2KCNH2ROCK2 | |
| SCHEMBL13365073 | 0.83 | KCNH2 (0.50) | CYP3A4KCNQ3KCNQ2KCNH2KCNQ4 | |
| SCHEMBL13364979 | 0.81 | KCNH2 (0.58) | KCNQ3KCNQ2KCNH2KCNQ4KCNQ5 | |
| SCHEMBL3346373 | 0.81 | KCNH2 (0.57) | KCNQ3KCNQ2KCNH2KCNQ4KCNQ5 | |
| SCHEMBL3346539 | 0.81 | KCNH2 (0.57) | KCNQ3KCNQ2KCNH2KCNQ4KCNQ5 | |
| SCHEMBL3348192 | 0.80 | KCNH2 (0.57) | KCNQ3KCNQ2KCNH2KCNQ4KCNQ5 | |
| SCHEMBL3346676 | 0.80 | KCNQ3 (0.53) | KCNQ3KCNQ2KCNH2KCNQ4KCNQ5 |
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 2 patents. 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 |
| WO-2010059922-A1 | PYRROLIDINE CARBOXAMIDE COMPOUNDS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2010-05-27 | — | — | WO | disclosed |