Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | NCOR1 | O75376 | 2/20 | 0.34 |
| ▸ | VNN1 | O95497 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8280024 | 0.75 | VCP (0.37) | VCPHDAC2HDAC1HDAC6HDAC3 | |
| SCHEMBL211981 | 0.74 | PI4KB (0.50) | VCPHDAC2HDAC1HDAC6CCNA2 | |
| SCHEMBL8279176 | 0.70 | HDAC1 (0.61) | HDAC2HDAC1HDAC6HDAC3NCOR1 | |
| SCHEMBL8280042 | 0.69 | HDAC1 (0.62) | HDAC2HDAC1HDAC6HDAC3NCOR1 | |
| SCHEMBL16408476 | 0.67 | VCP (0.59) | VCPHDAC2HDAC1HDAC6HDAC3 | |
| SCHEMBL27640625 | 0.65 | CYP17A1 (0.46) | NAMPTHDAC1HDAC6ACACBACACA | |
| SCHEMBL133327 | 0.65 | KMT2A (0.60) | NAMPTHDAC1 | |
| SCHEMBL8280224 | 0.64 | VCP (0.41) | VCPHDAC2HDAC1HDAC6HDAC3 | |
| SCHEMBL13879810 | 0.64 | CYP17A1 (0.55) | NAMPTHDAC1HDAC6AURKARPS6KB1 | |
| SCHEMBL13879808 | 0.64 | AURKA (0.50) | NAMPTHDAC2HDAC1HDAC6HDAC3 |
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-2005092899-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE INC. (CA) | 2005-10-06 | — | — | WO | disclosed |