Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 10/20 | 0.69 |
| ▸ | AAK1 | Q2M2I8 | 10/20 | 0.64 |
| ▸ | IMPDH1 | P20839 | 3/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.60 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.60 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.60 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.60 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.60 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.60 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.60 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.60 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.60 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.60 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL1472891 | 0.90 | IMPDH2 (0.85) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL15741685 | 0.90 | IMPDH2 (0.70) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL1473598 | 0.89 | IMPDH2 (0.82) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL15748408 | 0.87 | IMPDH2 (0.67) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL1472983 | 0.84 | IMPDH2 (0.68) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL15748760 | 0.84 | IMPDH2 (0.68) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL15748731 | 0.84 | IMPDH2 (0.68) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL14518601 | 0.83 | IMPDH2 (0.65) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL1475741 | 0.82 | IMPDH2 (1.00) | IMPDH2AAK1IMPDH1HDAC3HDAC4 | |
| SCHEMBL1475085 | 0.81 | IMPDH2 (1.00) | IMPDH2AAK1IMPDH1HDAC3HDAC4 |
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-2014079850-A1 | SUBSTITUTED HETEROCYCLIC DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2014-05-30 | — | — | WO | disclosed |