Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.44 |
| ▸ | CA9 | Q16790 | 5/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.40 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | UBE2N | P61088 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1666448 | 0.87 | CA2 (0.43) | CA2CA9PTPN11ENPP3ENPP1 | |
| SCHEMBL1565988 | 0.84 | KDM4E (0.53) | CA2CA9PTPN11ENPP3ENPP1 | |
| SCHEMBL20502501 | 0.82 | KDM4E (0.43) | CA2CA9PTPN11ENPP3ENPP1 | |
| SCHEMBL6015081 | 0.79 | ENPP3 (0.40) | CA2CA9PTPN11ENPP3ENPP1 | |
| SCHEMBL15882765 | 0.78 | ENPP3 (0.44) | CA2PTPN11ENPP3ENPP1KDM4E | |
| SCHEMBL15882666 | 0.78 | ENPP3 (0.45) | CA2PTPN11ENPP3ENPP1PTGDR2 | |
| SCHEMBL25179848 | 0.78 | CA2 (0.46) | CA2CA9PTPN11KDM4EUBE2N | |
| SCHEMBL721833 | 0.76 | BRD4 (0.51) | CA2PTPN11ENPP3ENPP1KDM4E | |
| SCHEMBL15155315 | 0.76 | ENPP3 (0.42) | CA2PTPN11ENPP3ENPP1KDM4E | |
| SCHEMBL16186613 | 0.76 | ENPP3 (0.42) | CA2PTPN11ENPP3ENPP1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1730146-A1 | AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES | Vertex Pharmaceuticals Incorporated (US) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005095400-A1 | AZAINDOLES USEFUL AS INHIBITORS OF JAK AND OTHER PROTEIN KINASES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-10-13 | — | — | WO | disclosed |