Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.65 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 8/20 | 0.52 |
| ▸ | PRKG1 | Q13976 | 5/20 | 0.52 |
| ▸ | CASR | P41180 | 2/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.44 |
| ▸ | PRKCG | P05129 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | PRKACA | P17612 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3347178 | 0.91 | KCNH2 (0.53) | KCNH2POLBMEN1KMT2ALMNA | |
| SCHEMBL3353100 | 0.91 | KCNH2 (0.68) | KCNH2POLBMEN1KMT2ALMNA | |
| SCHEMBL3348200 | 0.90 | KCNH2 (0.52) | KCNH2POLBMEN1KMT2ALMNA | |
| SCHEMBL3350659 | 0.87 | KCNH2 (0.68) | KCNH2ROCK2CASRCYP3A4CYP2D6 | |
| SCHEMBL13365111 | 0.87 | KCNH2 (0.68) | KCNH2ROCK2CASRCYP3A4CYP2D6 | |
| SCHEMBL3346274 | 0.87 | POLB (0.54) | KCNH2POLBMEN1KMT2ALMNA | |
| SCHEMBL3346364 | 0.87 | KCNH2 (0.68) | KCNH2ROCK2CASRCYP3A4CYP2D6 | |
| SCHEMBL3346599 | 0.87 | KCNH2 (0.68) | KCNH2ROCK2CASRCYP3A4CYP2D6 | |
| SCHEMBL3350854 | 0.87 | KCNH2 (0.49) | KCNH2POLBMEN1KMT2ALMNA | |
| SCHEMBL3346506 | 0.87 | KCNH2 (0.51) | KCNH2POLBMEN1KMT2ALMNA |
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 |