Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.51 |
| ▸ | PDE2A | O00408 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 3/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3346217 | 0.91 | KCNH2 (0.51) | KCNH2PDE2AACACBKIT | |
| SCHEMBL3346383 | 0.90 | KCNH2 (0.50) | KCNH2PDE2AMAPK1ROCK2ACACB | |
| SCHEMBL13365135 | 0.90 | KCNH2 (0.57) | KCNH2PDE2AACACB | |
| SCHEMBL3346567 | 0.89 | KCNH2 (0.59) | KCNH2PDE2AMAPK1ACACB | |
| SCHEMBL3350854 | 0.89 | KCNH2 (0.49) | KCNH2MAPK1ROCK2ROCK1 | |
| SCHEMBL3380842 | 0.87 | KCNH2 (0.40) | KCNH2MAPK1ROCK2KITJAK2 | |
| SCHEMBL13365111 | 0.86 | KCNH2 (0.68) | KCNH2PDE2AROCK2CASROPRM1 | |
| SCHEMBL3350659 | 0.86 | KCNH2 (0.68) | KCNH2PDE2AROCK2CASROPRM1 | |
| SCHEMBL3346554 | 0.83 | KCNH2 (0.48) | KCNH2PDE2AROCK2ACACBROCK1 | |
| SCHEMBL3347928 | 0.82 | KCNH2 (0.53) | KCNH2MAPK1ROCK2KITJAK2 |
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 |