Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 15/20 | 0.66 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.57 |
| ▸ | KDM1A | O60341 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.53 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.53 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1063750 | 0.85 | HDAC1 (0.83) | HDAC1HDAC2HDAC4MEF2DHDAC3 | |
| SCHEMBL1063749 | 0.85 | HDAC1 (0.83) | HDAC1HDAC2HDAC4MEF2DHDAC3 | |
| SCHEMBL8348757 | 0.85 | HDAC1 (0.83) | HDAC1HDAC2HDAC4MEF2DHDAC3 | |
| SCHEMBL13180899 | 0.82 | HDAC1 (0.64) | HDAC1HDAC2KDM1AMAOA | |
| SCHEMBL8348236 | 0.79 | HDAC1 (0.74) | HDAC1HDAC2KDM1AMAOAHDAC4 | |
| SCHEMBL1064568 | 0.79 | HDAC1 (1.00) | HDAC1HDAC2 | |
| SCHEMBL1064569 | 0.79 | HDAC1 (1.00) | HDAC1HDAC2 | |
| SCHEMBL8351280 | 0.79 | HDAC1 (1.00) | HDAC1HDAC2 | |
| SCHEMBL28633351 | 0.78 | KDM1A (0.85) | HDAC1HDAC2KDM1AMAOAHDAC6 | |
| SCHEMBL29721324 | 0.78 | KDM1A (0.85) | HDAC1HDAC2KDM1AMAOAHDAC6 |
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-2017195216-A1 | CYCLOPROPYL-AMIDE COMPOUNDS AS DUAL LSD1/HDAC INHIBITORS | JUBILANT BIOSYS LIMITED (IN) | 2017-11-16 | — | — | WO | disclosed |