Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.42 |
| ▸ | CDC42 | P60953 | 1/20 | 0.42 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.42 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.42 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.42 |
| ▸ | MC4R | P32245 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3346663 | 0.88 | KCNH2 (0.41) | GPBAR1ROCK2MC4RKCNH2 | |
| SCHEMBL3346548 | 0.86 | GPBAR1 (0.39) | GPBAR1ROCK2MC4R | |
| SCHEMBL3348201 | 0.83 | CNR1 (0.54) | GPBAR1ROCK2MC4R | |
| SCHEMBL3346376 | 0.79 | MC4R (0.63) | MC4RKCNH2 | |
| SCHEMBL3347822 | 0.77 | KCNH2 (0.45) | ROCK2CDC42PRKCEPRKG2PKN2 | |
| SCHEMBL3353041 | 0.76 | CNR1 (0.55) | ROCK2CDC42PRKCEPRKG2PKN2 | |
| SCHEMBL3346908 | 0.76 | MAPT (0.48) | ROCK2MC4R | |
| SCHEMBL3346278 | 0.76 | CNR1 (0.57) | ROCK2MC4RKCNH2 | |
| SCHEMBL3346412 | 0.75 | CNR1 (0.53) | ROCK2CDC42PRKCEPRKG2PKN2 | |
| SCHEMBL3347924 | 0.75 | TAAR1 (0.52) | GPBAR1ROCK2MC4RKCNH2 |
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 |