Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.64 |
| ▸ | CTSL | P07711 | 10/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.49 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.49 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12963542 | 0.90 | HDAC1 (0.69) | HDAC1HDAC2CTSLHDAC3HDAC4 | |
| SCHEMBL12933332 | 0.87 | HDAC1 (0.59) | HDAC1HDAC2CTSLHDAC3HDAC4 | |
| SCHEMBL6817839 | 0.86 | HDAC1 (0.67) | HDAC1HDAC2CTSLADORA1HDAC3 | |
| SCHEMBL8348467 | 0.85 | CTSL (0.57) | HDAC1HDAC2CTSLCDK1 | |
| SCHEMBL15756901 | 0.82 | YTHDC1 (0.69) | HDAC1HDAC2ADORA3ADORA1HDAC3 | |
| SCHEMBL13906495 | 0.80 | TLR9 (0.59) | HDAC1HDAC2CTSL | |
| SCHEMBL14024978 | 0.80 | ADORA2A (0.62) | HDAC1HDAC2ADORA1CDK1 | |
| SCHEMBL28771447 | 0.79 | PPARD (0.64) | HDAC1CTSLADORA3ADORA1YTHDC1 | |
| SCHEMBL5161283 | 0.78 | HDAC1 (0.49) | HDAC1HDAC2CTSLHDAC3HDAC4 | |
| SCHEMBL6821043 | 0.78 | CDK2 (0.62) | HDAC1HDAC2CTSLADORA3ADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003024448-A2 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE, INC. (CA) | 2003-03-27 | — | — | WO | disclosed |