Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.61 |
| ▸ | KDM1A | O60341 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.61 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.61 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.61 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.61 |
| ▸ | EP300 | Q09472 | 7/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | WNT1 | P04628 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL21462829 | 0.81 | HDAC1 (0.65) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| SCHEMBL21462830 | 0.81 | HDAC1 (0.65) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| Hydrochloric Acid SCHEMBL3434603 | 0.81 | HDAC1 (0.64) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| Hydrochloric Acid SCHEMBL3434610 | 0.81 | HDAC1 (0.64) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| SCHEMBL12438756 | 0.76 | HDAC1 (0.68) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| Domatinostat SCHEMBL1613939 | 0.76 | HDAC1 (1.00) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| Domatinostat SCHEMBL1613943 | 0.76 | HDAC1 (1.00) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| Domatinostat SCHEMBL30477018 | 0.76 | HDAC1 (1.00) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| SCHEMBL1885509 | 0.76 | HDAC1 (0.73) | HDAC3KDM1AHDAC1HDAC2HDAC10 | |
| Hydrochloric Acid SCHEMBL1889091 | 0.76 | HDAC1 (0.67) | HDAC3KDM1AHDAC1HDAC2HDAC10 |
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-20110086897-A1 | (E)-N-(2-Amino-phenyl)-3--acrylamide salts | 4SC AG (DE) | 2011-04-14 | — | — | US | claimed |