Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 8/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13833393 | 0.84 | HDAC2 (0.65) | HDAC2HDAC1GRIN2B | |
| SCHEMBL18079545 | 0.83 | HDAC2 (0.66) | HDAC2HDAC1 | |
| SCHEMBL19860010 | 0.82 | RAB9A (0.71) | HDAC2HDAC1KDM4ELMNANPC1 | |
| SCHEMBL30986004 | 0.81 | RAB9A (0.74) | HDAC2HDAC1KDM4ELMNANPC1 | |
| SCHEMBL14372234 | 0.77 | RAB9A (0.56) | KDM4ELMNANPC1RAB9AMAPT | |
| SCHEMBL19860011 | 0.76 | TAS1R3 (0.75) | LMNANPC1RAB9AMAPTMAPK1 | |
| SCHEMBL13833449 | 0.75 | HDAC2 (0.78) | HDAC2HDAC1 | |
| SCHEMBL18376433 | 0.74 | HDAC2 (1.00) | HDAC2HDAC1 | |
| SCHEMBL12432966 | 0.73 | KDM4E (0.64) | KDM4ELMNANPC1RAB9AMAPT | |
| SCHEMBL31020925 | 0.72 | HDAC2 (0.63) | HDAC2HDAC1GRIN2BMAPTTHRB |
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-9890172-B2 | Inhibitors of histone deacetylase | THE BROAD INSTITUTE, INC. (US) | 2018-02-13 | — | — | US | disclosed |