Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | LIMK2 | P53671 | 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 | |
|---|---|---|---|---|
| SCHEMBL6975585 | 1.00 | HDAC1 (0.43) | HDAC1HDAC6ALDH1A1LIMK1HDAC3 | |
| SCHEMBL6985372 | 0.94 | HDAC1 (0.42) | HDAC1HDAC6ALDH1A1LIMK1RORC | |
| SCHEMBL6985368 | 0.94 | HDAC1 (0.42) | HDAC1HDAC6ALDH1A1LIMK1RORC | |
| SCHEMBL6978220 | 0.91 | LIMK1 (0.39) | HDAC1HDAC6ALDH1A1LIMK1TP53 | |
| SCHEMBL6978224 | 0.91 | LIMK1 (0.39) | HDAC1HDAC6ALDH1A1LIMK1TP53 | |
| SCHEMBL6978234 | 0.91 | TP53 (0.41) | HDAC1HDAC6ALDH1A1LIMK1HDAC3 | |
| SCHEMBL6978230 | 0.91 | TP53 (0.41) | HDAC1HDAC6ALDH1A1LIMK1HDAC3 | |
| SCHEMBL6984569 | 0.90 | JAK3 (0.42) | HDAC1HDAC3HDAC2ROCK2 | |
| SCHEMBL6984575 | 0.90 | JAK3 (0.42) | HDAC1HDAC3HDAC2ROCK2 | |
| SCHEMBL8187758 | 0.90 | NAMPT (0.42) | HDAC1HDAC6HDAC3HDAC2HDAC4 |
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-1071665-B1 | SUBSTITUTED INDOLINONES HAVING AN INHIBITING EFFECT ON KINASES AND CYCLINE/CDK COMPLEXES | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-10-01 | — | — | EP | disclosed |
| US-6169106-B1 | ANTITUMOUR AGENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-01-02 | — | — | US | disclosed |