Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 8/20 | 0.40 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 2/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.35 |
| ▸ | QDPR | P09417 | 1/20 | 0.35 |
| ▸ | PLAT | P00750 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24364000 | 0.74 | PARP1 (0.42) | F2PARP1PARP2 | |
| SCHEMBL5224407 | 0.73 | HDAC2 (0.47) | — | |
| SCHEMBL6181512 | 0.70 | F2 (0.71) | F2PARP1IKBKBCHEK1 | |
| SCHEMBL24363838 | 0.69 | F2 (0.38) | F2PNMTIKBKB | |
| SCHEMBL30471065 | 0.69 | F2 (0.38) | F2PNMTIKBKB | |
| SCHEMBL30711293 | 0.68 | SLC18A3 (0.42) | GABRA1GABRG2GABRB3SLC18A3SIGMAR1 | |
| SCHEMBL17065258 | 0.68 | GSK3B (0.50) | — | |
| SCHEMBL6956559 | 0.68 | HTR2C (0.46) | GABRA1GABRG2GABRB3SLC18A3SIGMAR1 | |
| SCHEMBL1758181 | 0.68 | CYP2C9 (0.55) | PARP1SLC18A3SIGMAR1PARP2QDPR | |
| SCHEMBL6486918 | 0.68 | SLC18A3 (0.38) | GABRA1GABRG2GABRB3SLC18A3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1662236-A | Inhibitors of histone deacetylase | ASTRAZENECA AB (SE) | 2005-08-31 | — | — | CN | disclosed |