Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 19/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5031094 | 0.88 | HDAC2 (0.55) | HDAC1HDAC3HDAC2 | |
| SCHEMBL5028853 | 0.82 | KCNH2 (0.59) | HDAC1HDAC3HDAC2HDAC4HDAC7 | |
| SCHEMBL5031042 | 0.81 | HDAC1 (0.71) | HDAC1HDAC3HDAC2MAPK1NCOR2 | |
| SCHEMBL1689396 | 0.79 | HDAC1 (0.53) | HDAC1HDAC3HDAC2MAPK1NCOR2 | |
| SCHEMBL2106455 | 0.78 | HDAC1 (0.65) | HDAC1HDAC3HDAC2MAPK1NCOR2 | |
| SCHEMBL5035397 | 0.78 | HDAC1 (0.65) | HDAC1HDAC3HDAC2MAPK1NCOR2 | |
| SCHEMBL5028824 | 0.76 | HDAC1 (0.56) | HDAC1HDAC3HDAC2MAPK1NCOR2 | |
| SCHEMBL5132292 | 0.74 | HDAC1 (0.54) | HDAC1HDAC3HDAC2MAPK1NCOR2 | |
| SCHEMBL5031015 | 0.73 | HDAC1 (0.70) | HDAC1HDAC3HDAC2HDAC4HDAC7 | |
| SCHEMBL5031985 | 0.73 | PTGS1 (0.59) | HDAC1HDAC3HDAC2PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896395-B1 | MODIFIED MALONATE DERIVATIVES | MERCK SHARP & DOHME (US) | 2015-07-15 | — | — | EP | claimed |
| EP-1896395-A2 | MODIFIED MALONATE DERIVATIVES | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | claimed |
| WO-2007002248-A2 | MODIFIED MALONATE DERIVATIVES | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | claimed |