Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F9 | P00740 | 5/20 | 0.42 |
| ▸ | F11 | P03951 | 2/20 | 0.37 |
| ▸ | F7 | P08709 | 2/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.34 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL1231102 | 0.79 | ABCG2 (0.57) | F9ABCG2KDM1ATHRBRXFP1 | |
| SCHEMBL1232626 | 0.74 | F9 (0.48) | F9F11F7F10CYP2C9 | |
| SCHEMBL1231131 | 0.72 | HTR2A (0.46) | F9F11F7F10CYP2C9 | |
| SCHEMBL1232542 | 0.71 | F9 (0.74) | F9F11F7F10CYP2C9 | |
| SCHEMBL6920296 | 0.67 | MEN1 (0.37) | F9CYP2C9ABCG2KDM1AGSK3B | |
| SCHEMBL6919662 | 0.65 | ABCG2 (0.55) | ABCG2KDM1ATHRBRXFP1PDE4B | |
| SCHEMBL17528761 | 0.64 | L3MBTL1 (0.43) | CYP2C9ABCG2MEN1GBA1KMT2A | |
| SCHEMBL22544968 | 0.64 | ABCG2 (0.42) | ABCG2 | |
| SCHEMBL29407620 | 0.64 | ACHE (0.35) | — | |
| SCHEMBL6919971 | 0.63 | F9 (0.48) | F9F11F7F10CYP2C9 |
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-2011017296-A1 | 4, 5, 6-TRISUBSTITUTED PYRIMIDINE DERIVATIVES AS FACTOR IXA INHIBITORS | SCHERING CORPORATION (US) | 2011-02-10 | — | — | WO | disclosed |