Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 2/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 11/20 | 0.49 |
| ▸ | BMPR2 | Q13873 | 2/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | WDR5 | P61964 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | GRK2 | P25098 | 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 | |
|---|---|---|---|---|
| SCHEMBL10066965 | 0.82 | F10 (0.53) | F10ROCK2BMPR2ENPP2ROCK1 | |
| SCHEMBL10066502 | 0.82 | ROCK2 (0.61) | F10ROCK2BMPR2ENPP2ROCK1 | |
| SCHEMBL10022702 | 0.77 | ROCK2 (0.68) | ROCK2 | |
| SCHEMBL10022599 | 0.77 | ROCK2 (0.76) | ROCK2ROCK1 | |
| SCHEMBL10022673 | 0.70 | HCAR2 (0.49) | NPC1 | |
| SCHEMBL27817481 | 0.69 | CDC7 (0.49) | NPC1 | |
| SCHEMBL27605419 | 0.69 | CDC7 (0.45) | NPC1 | |
| SCHEMBL13068789 | 0.69 | MMP13 (0.59) | F10ROCK2ROCK1 | |
| SCHEMBL28595774 | 0.68 | CDC7 (0.69) | GSK3B | |
| SCHEMBL3647370 | 0.68 | ALDH1A1 (0.64) | NPC1 |
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-2012006203-A1 | N-CYCLYL-3 - (CYCLYLCARBONYLAMINOMETHYL) BENZAMIDE DERIVATIVES AS RHO KINASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |