Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.51 |
| ▸ | XIAP | P98170 | 1/20 | 0.49 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.44 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | NPC1L1 | Q9UHC9 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 2/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14530335 | 0.86 | HDAC1 (0.59) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL26969728 | 0.86 | HDAC1 (0.61) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL14530334 | 0.86 | HDAC1 (0.61) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL6395630 | 0.84 | HDAC1 (0.57) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL26969693 | 0.83 | HDAC1 (0.56) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL2800892 | 0.83 | HDAC1 (0.56) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL14529872 | 0.83 | HDAC1 (0.56) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL1195680 | 0.83 | HDAC1 (0.63) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL1195682 | 0.83 | HDAC1 (0.63) | HDAC1HDAC8HDAC6P2RY1XIAP | |
| SCHEMBL21989213 | 0.83 | HDAC1 (0.55) | HDAC1HDAC8HDAC6P2RY1XIAP |
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-1998018762-A1 | NEW DERIVATIVES OF DIVERSELY SUBSTITUTED CYCLICAL AMIDE SELECTIVE ANTAGONISTS OF THE HUMAN RECEPTOR NK3, PROCESS FOR OBTAINING THEM, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SANOFI (FR) | 1998-05-07 | — | — | WO | disclosed |