Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | ATR | Q13535 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.44 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | CHUK | O15111 | 1/20 | 0.44 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.44 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7061214 | 0.81 | MAP4K4 (0.59) | ABL1HSP90AA1HSP90AB1ADORA1ADORA3 | |
| SCHEMBL7059614 | 0.80 | SCN10A (0.53) | HSP90AA1HSP90AB1ADORA3KDM4ESCN9A | |
| SCHEMBL7059298 | 0.75 | SCN10A (0.66) | HSP90AA1HSP90AB1ADORA3KDM4ESCN9A | |
| SCHEMBL1145490 | 0.75 | MAPK8 (0.78) | ADORA1ADORA2BCDK2CHUKPRKD3 | |
| SCHEMBL5991130 | 0.74 | DHFR (0.53) | ATRADORA1ADORA2BMAP4K4DHFR | |
| SCHEMBL7061212 | 0.73 | KDM4E (0.52) | ABL1ATRHSP90AA1HSP90AB1ADORA1 | |
| SCHEMBL10206293 | 0.73 | ABL1 (0.58) | ABL1KDRHSP90AA1HSP90AB1DYRK1A | |
| SCHEMBL14889591 | 0.70 | ATR (0.46) | ATRMAP4K4DHFRFYN | |
| SCHEMBL20658551 | 0.70 | ADORA2A (0.61) | KDRHSP90AA1HSP90AB1ADORA1ADORA3 | |
| SCHEMBL3890142 | 0.69 | MAPK14 (0.63) | ABL1KDRPRKD3MAP4K4MAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0966448-B1 | PYRAZINE COMPOUNDS | GLAXO GROUP LTD (GB) | 2003-10-01 | — | — | EP | disclosed |