Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 10/20 | 0.47 |
| ▸ | MEN1 | O00255 | 8/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3234299 | 0.90 | RAB9A (0.48) | KMT2AMEN1NPC1RAB9AMAPT | |
| SCHEMBL3240737 | 0.84 | MAPK14 (0.48) | KMT2AMEN1NPC1RAB9AMAPT | |
| SCHEMBL3236826 | 0.82 | KDM4E (0.38) | NPC1RAB9AMAPTALDH1A1LMNA | |
| SCHEMBL3235671 | 0.81 | GRM1 (0.44) | KMT2AMEN1NPC1RAB9AMAPT | |
| SCHEMBL3238500 | 0.80 | RAB9A (0.48) | KMT2AMEN1NPC1RAB9AMAPT | |
| SCHEMBL3262051 | 0.76 | CYP1A2 (0.43) | KMT2AMEN1NPC1RAB9AMAPT | |
| SCHEMBL3238571 | 0.75 | HDAC1 (0.36) | KMT2AMEN1MAPTALDH1A1HDAC3 | |
| SCHEMBL3262923 | 0.75 | GRM1 (0.44) | KMT2AMEN1MAPTALDH1A1LMNA | |
| SCHEMBL3233610 | 0.75 | KDM4E (0.38) | NPC1RAB9AMAPTALDH1A1LMNA | |
| SCHEMBL3237150 | 0.74 | HDAC1 (0.41) | KMT2AMEN1NPC1RAB9AALDH1A1 |
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-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |