Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | HPGDS | O60760 | 7/20 | 0.43 |
| ▸ | TBK1 | Q9UHD2 | 4/20 | 0.41 |
| ▸ | SYK | P43405 | 5/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.39 |
| ▸ | CCNK | O75909 | 1/20 | 0.38 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19819913 | 0.92 | HPGDS (0.44) | TDO2HPGDSTBK1SYKCNR1 | |
| SCHEMBL15473152 | 0.89 | FLT3 (0.42) | HPGDSTBK1CNR1CNR2 | |
| SCHEMBL15473174 | 0.86 | TDO2 (0.46) | TDO2TBK1SYKCCNKCDK12 | |
| SCHEMBL16664942 | 0.86 | SYK (0.49) | TDO2TBK1SYKIKBKECCNK | |
| SCHEMBL15343201 | 0.84 | PIK3CA (0.41) | TDO2TBK1SYKCCR6 | |
| SCHEMBL16664992 | 0.83 | CDK1 (0.41) | HPGDSTBK1SYKIKBKE | |
| SCHEMBL15473175 | 0.82 | HPGDS (0.43) | HPGDSTBK1IKBKE | |
| SCHEMBL16664999 | 0.80 | HPGDS (0.36) | HPGDSTBK1IKBKE | |
| SCHEMBL19819895 | 0.79 | TDO2 (0.44) | TDO2TBK1SYKCCNKCDK12 | |
| SCHEMBL15473156 | 0.76 | CDK1 (0.40) | HPGDSTBK1SYKIKBKE |
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-2015058031-A1 | DNA-PK INHIBITORS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2015-04-23 | — | — | WO | disclosed |