Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.43 |
| ▸ | CDC7 | O00311 | 2/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27865706 | 0.91 | HPGD (0.43) | HPGDPIK3CAHCAR2TGFBR1PTPN11 | |
| SCHEMBL28799905 | 0.88 | CDC7 (0.43) | HPGDCDC7ROCK2MAP4K4CDK2 | |
| SCHEMBL27865694 | 0.85 | HPGD (0.41) | HPGDCDC7ROCK2MAP4K4CDK2 | |
| SCHEMBL12812433 | 0.83 | HPGD (0.44) | HPGDCDC7ROCK2MAP4K4CDK2 | |
| SCHEMBL1442584 | 0.80 | HPGD (0.58) | HPGDPIK3CAHCAR2MKNK1MKNK2 | |
| SCHEMBL28799885 | 0.80 | HPGD (0.40) | HPGDCDC7ROCK2MAP4K4CDK2 | |
| SCHEMBL1443768 | 0.79 | PTPN11 (0.47) | HPGDPIK3CAPTPN11ALDH1A1POLB | |
| SCHEMBL27865719 | 0.78 | PKMYT1 (0.45) | HPGDPIK3CAHCAR2ALDH1A1MKNK1 | |
| SCHEMBL1443528 | 0.77 | HPGD (0.50) | HPGDPIK3CAHCAR2CDK9MET | |
| SCHEMBL1442640 | 0.77 | ESR2 (0.46) | HPGDPIK3CAHCAR2PTPN11ALDH1A1 |
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-102596932-A | Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors | BAYER SCHERING PHARMA AG | 2012-07-18 | — | — | CN | claimed |