Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | TBK1 | Q9UHD2 | 6/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.38 |
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CCNK | O75909 | 1/20 | 0.36 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12068204 | 0.90 | PTPN11 (0.42) | PTPN11GPR119MAP3K11 | |
| SCHEMBL12066045 | 0.87 | PTPN11 (0.47) | PTPN11MAP3K11KDM1A | |
| SCHEMBL22324681 | 0.86 | PTPN11 (0.47) | PTPN11TBK1CA12CA1CA2 | |
| SCHEMBL7515012 | 0.85 | MAP3K11 (0.55) | PTPN11TBK1MAP3K11IDO1TDO2 | |
| SCHEMBL7900013 | 0.80 | MAP3K11 (0.58) | MAP3K11 | |
| SCHEMBL30280390 | 0.79 | PTPN11 (0.42) | PTPN11TP53 | |
| SCHEMBL7907976 | 0.79 | PTPN11 (0.50) | PTPN11IDO1 | |
| SCHEMBL12066674 | 0.78 | PTPN11 (0.49) | PTPN11IDO1 | |
| SCHEMBL31396526 | 0.78 | PTPN11 (0.41) | PTPN11GPR119MEN1KMT2ATP53 | |
| SCHEMBL12066665 | 0.77 | MAP3K11 (0.47) | PTPN11MAP3K11IDO1 |
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-2011149950-A2 | BICYCLIC HETEROARYL KINASE INHIBITORS AND METHODS OF USE | UNIVERSITY OF ROCHESTER (US) | 2011-12-01 | — | — | WO | disclosed |