Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 13/20 | 0.91 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.91 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.91 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.91 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.91 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.91 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.91 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.67 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Tinostamustine SCHEMBL29412228 | 0.95 | HDAC1 (1.00) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL12104079 | 0.95 | HDAC1 (1.00) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL7915764 | 0.95 | HDAC1 (1.00) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| Tinostamustine SCHEMBL7915449 | 0.95 | HDAC1 (1.00) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL24220325 | 0.92 | HDAC6 (0.93) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL15711929 | 0.92 | HDAC6 (0.92) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL12102557 | 0.88 | HDAC6 (0.85) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL7917346 | 0.88 | HDAC1 (0.85) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL16866939 | 0.88 | HDAC6 (0.85) | HDAC1HDAC6HDAC2HDAC3HDAC4 | |
| SCHEMBL16866938 | 0.88 | HDAC6 (0.85) | HDAC1HDAC6HDAC2HDAC3HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013113838-A1 | NOVEL THERAPEUTIC AGENTS | EURO-CELTIQUE (LU) | 2013-08-08 | — | — | WO | disclosed |
| WO-2013113841-A1 | NOVEL THERAPEUTIC AGENTS | EURO-CELTIQUE S.A. (LU) | 2013-08-08 | — | — | WO | disclosed |