Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL991567 | 0.83 | CYP2A6 (0.42) | — | |
| Hydrochloric Acid SCHEMBL5060581 | 0.81 | KDM1A (0.40) | — | |
| SCHEMBL10132207 | 0.80 | MEN1 (0.39) | HSD11B1MEN1CYP2C9KMT2AMAOA | |
| SCHEMBL8005872 | 0.80 | MAOB (0.39) | HSD11B1MEN1CYP2C9KMT2AMAOA | |
| SCHEMBL10241812 | 0.79 | MAOA (0.36) | HSD11B1MEN1KMT2AMAOAMAOB | |
| SCHEMBL614021 | 0.79 | MEN1 (0.63) | MEN1CYP2C9KMT2A | |
| SCHEMBL9966307 | 0.79 | AKT1 (0.41) | — | |
| SCHEMBL255382 | 0.79 | AKT2 (0.44) | — | |
| Hydrochloric Acid SCHEMBL5767667 | 0.78 | MAOB (0.38) | HSD11B1MEN1CYP2C9KMT2AMAOA | |
| Hydrochloric Acid SCHEMBL5383464 | 0.78 | MEN1 (0.61) | MEN1CYP2C9KMT2A |
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-2009156100-A1 | SUBSTITUTED ISOQUINOLINES AND ISOQUINOLINONES AS RHO KINASE INHIBITORS | SANOFI-AVENTIS (FR) | 2009-12-30 | — | — | WO | disclosed |