Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.59 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.48 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.47 |
| ▸ | KCNQ3 | O43525 | 3/20 | 0.44 |
| ▸ | KCNQ2 | O43526 | 3/20 | 0.44 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.44 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 3/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 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 | |
|---|---|---|---|---|
| SCHEMBL3353295 | 0.87 | GPR88 (0.52) | KCNH2GPR88KCNQ3KCNQ2TDP1 | |
| SCHEMBL3346321 | 0.86 | KCNH2 (0.77) | KCNH2KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL3346433 | 0.84 | KCNH2 (0.56) | KCNH2 | |
| SCHEMBL3346531 | 0.84 | GPR88 (0.66) | KCNH2KCNA5GPR88KCNQ3KCNQ2 | |
| SCHEMBL3346210 | 0.81 | KCNH2 (0.59) | KCNH2MC4RCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3416539 | 0.81 | GPR88 (0.45) | KCNH2GPR88KCNQ3KCNQ2KCNQ4 | |
| SCHEMBL3353261 | 0.81 | GPR88 (0.46) | GPR88KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL13365061 | 0.78 | KCNH2 (0.79) | KCNH2MC4RCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3350446 | 0.78 | KCNH2 (0.79) | KCNH2MC4RCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3346364 | 0.78 | KCNH2 (0.68) | KCNH2KCNQ3KCNQ2KCNQ4KCNQ5 |
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 |