Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20987622 | 1.00 | HDAC8 (0.44) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL21499101 | 1.00 | HDAC8 (0.44) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL5875341 | 1.00 | HDAC8 (0.44) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL28681232 | 1.00 | HDAC8 (0.44) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL19271855 | 1.00 | HDAC8 (0.44) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL23861793 | 1.00 | HDAC8 (0.44) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL10633066 | 0.98 | HDAC8 (0.43) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL18896255 | 0.98 | TDP1 (0.45) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL11458527 | 0.96 | HDAC8 (0.43) | HDAC8HDAC3HDAC6HDAC1HDAC2 | |
| SCHEMBL24404172 | 0.96 | HDAC8 (0.43) | HDAC8HDAC3HDAC6HDAC1HDAC2 |
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-1963253-A2 | RING ALKYLATION OF ANILINE OR AN ANILINE DERIVATIVE USING IONIC LIQUID CATALYSTS | CHEMTURA CORPORATION (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007070263-A2 | RING ALKYLATION OF ANILINE OR AN ANILINE DERIVATIVE USING IONIC LIQUID CATALYSTS | CHEMTURA CORPORATION (US) | 2007-06-21 | — | — | WO | disclosed |