Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.59 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.52 |
| ▸ | XIAP | P98170 | 1/20 | 0.50 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.50 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.50 |
| ▸ | TACR1 | P25103 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | NPC1L1 | Q9UHC9 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TACR2 | P21452 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14623151 | 0.89 | APP (0.47) | HDAC1HDAC6HDAC8FFAR1NPC1L1 | |
| SCHEMBL1195680 | 0.86 | HDAC1 (0.63) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL1195682 | 0.86 | HDAC1 (0.63) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL14529872 | 0.84 | HDAC1 (0.56) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL13228096 | 0.83 | HDAC1 (0.68) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL12049087 | 0.83 | HDAC1 (0.59) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL14530334 | 0.83 | HDAC1 (0.61) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL14530335 | 0.83 | HDAC1 (0.59) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL1587816 | 0.82 | HDAC1 (0.61) | HDAC1HDAC6HDAC8P2RY1XIAP | |
| SCHEMBL2878354 | 0.82 | TACR1 (0.68) | HDAC1HDAC6HDAC8TACR1GHSR |
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-2007002637-A1 | N-LINKED HETEROCYCLIC ANTAGONISTS OF P2Y1 RECEPTOR USEFUL IN THE TREATMENT OF THROMBOTIC CONDITIONS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-01-04 | — | — | WO | disclosed |