Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 3/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2982201 | 0.86 | NOTUM (0.62) | NOTUMROCK2ROCK1AKT1HSD11B1 | |
| SCHEMBL6543320 | 0.86 | NOTUM (0.57) | NOTUMROCK2ROCK1AKT1P2RY1 | |
| SCHEMBL8225944 | 0.83 | NOTUM (0.48) | NOTUMROCK2ROCK1CYP1A2CYP3A4 | |
| SCHEMBL2984971 | 0.82 | NOTUM (0.48) | NOTUMROCK2ROCK1CYP1A2CYP3A4 | |
| SCHEMBL1713623 | 0.78 | NOTUM (0.60) | NOTUMROCK2ROCK1AKT1HSD11B1 | |
| SCHEMBL12316015 | 0.74 | NOTUM (0.46) | NOTUMROCK2ROCK1AKT1HSD11B1 | |
| SCHEMBL30232786 | 0.74 | NOTUM (0.63) | NOTUMROCK2ROCK1AKT1P2RY1 | |
| SCHEMBL1572534 | 0.74 | NOTUM (0.63) | NOTUMROCK2ROCK1AKT1P2RY1 | |
| SCHEMBL655024 | 0.73 | NOTUM (0.80) | NOTUMROCK2ROCK1AKT1P2RY1 | |
| SCHEMBL14529913 | 0.73 | NOTUM (0.57) | NOTUMROCK2ROCK1AKT1P2RY1 |
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-2008021545-A2 | MODULATORS OF MUSCARINIC RECEPTORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-02-21 | — | — | WO | disclosed |