Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7453011 | 0.89 | HDAC1 (0.41) | HDAC1HDAC6FDPSHDAC8ALDH1A1 | |
| SCHEMBL7552107 | 0.78 | HDAC8 (0.48) | HDAC1HDAC6FDPSHDAC8ALDH1A1 | |
| SCHEMBL7451329 | 0.77 | FDPS (0.41) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL11904867 | 0.75 | FDPS (0.40) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL7456848 | 0.71 | FDPS (0.40) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL7450504 | 0.69 | FDPS (0.41) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL7446851 | 0.68 | FDPS (0.40) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL7455152 | 0.68 | FDPS (0.42) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL7446654 | 0.68 | FDPS (0.42) | HDAC1HDAC6FDPSALDH1A1LMNA | |
| SCHEMBL7457885 | 0.67 | FDPS (0.37) | HDAC1HDAC6FDPSALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0920430-A1 | PURINE DERIVATIVES AND THEIR USE AS ANTI-COAGULANTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998007725-A1 | PURINE DERIVATIVES AND THEIR USE AS ANTI-COAGULANTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-02-26 | — | — | WO | disclosed |