Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PLAT | P00750 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | TNKS | O95271 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | TNKS2 | Q9H2K2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8962629 | 0.94 | HDAC2 (0.33) | HDAC2 | |
| SCHEMBL8962633 | 0.94 | HDAC2 (0.33) | HDAC2 | |
| SCHEMBL8962838 | 0.91 | SLC6A3 (0.39) | SLC6A3PLATERN1HDAC2TNKS | |
| SCHEMBL8962846 | 0.91 | SLC6A3 (0.39) | SLC6A3PLATERN1HDAC2TNKS | |
| SCHEMBL8963174 | 0.85 | FFAR4 (0.31) | — | |
| SCHEMBL8963181 | 0.85 | FFAR4 (0.31) | — | |
| SCHEMBL8962789 | 0.82 | NAAA (0.34) | HDAC2 | |
| SCHEMBL8962781 | 0.82 | NAAA (0.34) | HDAC2 | |
| SCHEMBL8962761 | 0.81 | PANK3 (0.35) | HDAC2 | |
| SCHEMBL9450894 | 0.81 | SLC6A2 (0.32) | SLC6A3 |
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-1993007234-A1 | HALOVINYL-DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-15 | — | — | WO | disclosed |