Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 14/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 12/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11297379 | 0.90 | HDAC1 (0.42) | HDAC1HDAC6HDAC8HDAC2HDAC3 | |
| SCHEMBL11304432 | 0.89 | HDAC6 (0.40) | HDAC1HDAC6HDAC8HDAC2HDAC3 | |
| SCHEMBL11296090 | 0.83 | HDAC6 (0.41) | HDAC1HDAC6HDAC8HDAC2HDAC3 | |
| SCHEMBL11294915 | 0.81 | HDAC6 (0.50) | HDAC1HDAC6HDAC8ALDH1A1POLB | |
| SCHEMBL11298764 | 0.80 | HDAC1 (0.46) | HDAC1HDAC6HDAC8ALDH1A1KDR | |
| SCHEMBL11294786 | 0.78 | HDAC6 (0.46) | HDAC1HDAC6HDAC8TDP1KDR | |
| SCHEMBL202512 | 0.70 | HDAC1 (0.65) | HDAC1HDAC6HDAC8ALDH1A1FLT1 | |
| SCHEMBL11301754 | 0.69 | PSEN1 (0.42) | HDAC1HDAC6HDAC8ALDH1A1POLB | |
| SCHEMBL11298688 | 0.68 | HDAC8 (0.42) | HDAC1HDAC6HDAC8ALDH1A1POLB | |
| SCHEMBL11303497 | 0.67 | HDAC8 (0.46) | HDAC1HDAC6HDAC8ALDH1A1POLB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2665706-A1 | NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES AS HDAC INHIBITORS FOR THE TREATMENT OF CANCER | F.HOFFMANN-LA ROCHE AG (CH) | 2013-11-27 | — | — | EP | claimed |
| WO-2012098132-A1 | NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES AS HDAC INHIBITORS FOR THE TREATMENT OF CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2012-07-26 | — | — | WO | claimed |
| EP-2665706-A1 | NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES AS HDAC INHIBITORS FOR THE TREATMENT OF CANCER | F.HOFFMANN-LA ROCHE AG (CH) | 2013-11-27 | — | — | EP | disclosed |
| WO-2012098132-A1 | NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES AS HDAC INHIBITORS FOR THE TREATMENT OF CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2012-07-26 | — | — | WO | disclosed |