Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | GCK | P35557 | 1/20 | 0.33 |
| ▸ | CYP46A1 | Q9Y6A2 | 5/20 | 0.33 |
| ▸ | ABL1 | P00519 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3151394 | 0.87 | NTRK1 (0.33) | ROCK2PDE3BPDE3AGCK | |
| Hydrochloric Acid SCHEMBL3784272 | 0.86 | NTRK1 (0.33) | ROCK2PDE3BPDE3AGCK | |
| SCHEMBL3776471 | 0.84 | PDE3B (0.36) | ROCK2PDE3BPDE3ARAF1BRAF | |
| Hydrochloric Acid SCHEMBL3779075 | 0.80 | RARG (0.37) | ABL1 | |
| SCHEMBL3151038 | 0.75 | ABL1 (0.33) | ABL1 | |
| SCHEMBL3146956 | 0.75 | PIK3CA (0.33) | ROCK2CYP11B1CYP11B2 | |
| SCHEMBL3151458 | 0.73 | ABL1 (0.36) | ABL1 | |
| SCHEMBL3151465 | 0.72 | ABL1 (0.35) | ABL1 | |
| SCHEMBL3779179 | 0.70 | ROCK2 (0.32) | ROCK2CYP46A1 | |
| SCHEMBL3151064 | 0.70 | RAF1 (0.38) | PDE3BPDE3ARAF1BRAFCYP46A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1979321-B9 | NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SERVIER LAB (FR) | 2010-02-17 | — | — | EP | disclosed |
| EP-1979321-B1 | NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SERVIER LAB (FR) | 2009-07-29 | — | — | EP | disclosed |