Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
| ▸ | UBE2M | P61081 | 1/20 | 0.40 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28466070 | 0.78 | HDAC1 (0.51) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL13664690 | 0.77 | HDAC3 (0.40) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL19294226 | 0.74 | HDAC1 (0.46) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL13664857 | 0.74 | UBE2M (0.41) | UBE2MDCUN1D1EPHX2MEN1KMT2A | |
| SCHEMBL4147838 | 0.73 | HDAC1 (0.56) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL757279 | 0.72 | HDAC1 (0.48) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7029210 | 0.72 | CASR (0.49) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL17595115 | 0.72 | BACE1 (0.49) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL3328177 | 0.71 | HDAC3 (0.54) | BACE1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL9823156 | 0.71 | HDAC1 (0.54) | HDAC3HDAC1HDAC2NCOR2MEN1 |
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-2009119528-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |