Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 9/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1324278 | 1.00 | HDAC1 (0.39) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1323721 | 0.95 | LMNA (0.40) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1323310 | 0.95 | LMNA (0.40) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1323314 | 0.95 | LMNA (0.40) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1323607 | 0.95 | LMNA (0.40) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1324397 | 0.85 | CYP1A2 (0.46) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1324399 | 0.85 | CYP1A2 (0.46) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1324753 | 0.85 | HDAC2 (0.53) | HDAC1HDAC4HDAC8HDAC2HDAC3 | |
| SCHEMBL1324636 | 0.85 | CA12 (0.49) | LMNAKMT2AMMP1MMP2MMP9 | |
| SCHEMBL1324751 | 0.85 | HDAC2 (0.53) | HDAC1HDAC4HDAC8HDAC2HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-8058313-B2 | 4-((1E)-2-(((E)-2-fluoro-4-cyanostyrylsulfonyl)methylsulfonyl)vinyl)-3-fluoro-benzonitrile; mitogen activated protein kinase inhibitor; cell growth factor receptor antagonist; angiogenesis inhibitor, antiproliferative and anticarcinogenic agent; neurodegenerative diseases | Temple University—Of the Commonwealth System of Higher Education (US) | 2011-11-15 | — | — | US | claimed |