Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | KIT | P10721 | 2/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | CSF1R | P07333 | 1/20 | 0.44 |
| ▸ | IGF1R | P08069 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | FLT4 | P35916 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | TEK | Q02763 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.43 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4725101 | 0.91 | MEN1 (0.55) | CYP3A4KITABL1CSF1RIGF1R | |
| SCHEMBL4725045 | 0.89 | KMT2A (0.48) | CYP3A4ROCK2ROCK1KITABL1 | |
| SCHEMBL4727611 | 0.89 | ABL1 (0.51) | CYP3A4ROCK2ROCK1KITABL1 | |
| SCHEMBL4777946 | 0.88 | DEGS1 (0.47) | ROCK2ROCK1KITABL1CSF1R | |
| Hydrochloric Acid SCHEMBL4725333 | 0.88 | ABL1 (0.50) | CYP3A4ROCK2ROCK1KITABL1 | |
| SCHEMBL4726122 | 0.87 | KDR (0.46) | ROCK2ROCK1KITABL1CSF1R | |
| SCHEMBL4779689 | 0.87 | SERPINE1 (0.49) | ROCK2ROCK1KITABL1CSF1R | |
| SCHEMBL4727987 | 0.86 | CFTR (0.53) | ROCK2ROCK1KITABL1CSF1R | |
| SCHEMBL4726501 | 0.86 | CYP3A4 (0.49) | CYP3A4MAOBMEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL4725088 | 0.86 | CYP3A4 (0.48) | CYP3A4MAOBMEN1KMT2AMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008021725-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | claimed |
| WO-2008021725-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |
| WO-2008021725-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |