Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 16/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.39 |
| ▸ | BCL9 | O00512 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | F7 | P08709 | 1/20 | 0.36 |
| ▸ | F3 | P13726 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.36 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4668128 | 0.88 | HDAC1 (0.49) | HDAC1HDAC2HDAC3NCOR2BCL9 | |
| SCHEMBL2685764 | 0.88 | HDAC1 (0.60) | HDAC1HDAC2HDAC3NCOR2 | |
| SCHEMBL2686087 | 0.86 | HDAC1 (0.46) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL5548615 | 0.83 | HDAC1 (0.42) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL2685864 | 0.79 | HDAC1 (0.62) | HDAC1HDAC2HDAC3HDAC8HDAC6 | |
| SCHEMBL2685397 | 0.76 | HDAC1 (0.65) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL4781161 | 0.74 | HDAC1 (0.51) | HDAC1HDAC2HDAC3NCOR2F2 | |
| SCHEMBL2685888 | 0.74 | HDAC1 (0.58) | HDAC1HDAC2HDAC3NCOR2 | |
| SCHEMBL2687187 | 0.74 | HDAC1 (0.58) | HDAC1HDAC2HDAC3NCOR2 | |
| SCHEMBL13913375 | 0.74 | HDAC1 (0.57) | HDAC1HDAC2HDAC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1991226-A2 | INHIBITORS OF HISTONE DEACETYLASE | Merck & Co., Inc. (US) | 2008-11-19 | — | — | EP | disclosed |
| WO-2007100657-A2 | INHIBITORS OF HISTONE DEACETYLASE | MERCK & CO., INC. (US) | 2007-09-07 | — | — | WO | disclosed |