Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 3/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 12/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | PIKFYVE | Q9Y2I7 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4742391 | 0.91 | TYMS (0.45) | TYMSADORA2AADORA1DPP4HSP90AB1 | |
| SCHEMBL4739911 | 0.88 | TYMS (0.52) | TYMSADORA2AADORA1HSP90AB1ADORA2B | |
| SCHEMBL4740440 | 0.85 | TYMS (0.41) | TYMSADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL4736837 | 0.79 | TYMS (0.38) | TYMSADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL4737447 | 0.79 | TYMS (0.38) | TYMSADORA2AADORA1 | |
| SCHEMBL4737435 | 0.79 | TYMS (0.47) | TYMS | |
| SCHEMBL8261591 | 0.79 | TYMS (0.59) | TYMSHSP90AB1 | |
| SCHEMBL14148121 | 0.79 | TYMS (0.63) | TYMSHSP90AB1 | |
| SCHEMBL14148437 | 0.77 | TYMS (0.56) | TYMSHSP90AB1 | |
| SCHEMBL4737411 | 0.74 | ADORA2A (0.39) | TYMSADORA2AADORA1PIKFYVE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008086158-A1 | BENZODIHYDROQUINAZOLINE AS PI3 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-07-17 | — | — | WO | disclosed |
| WO-2008086158-A1 | BENZODIHYDROQUINAZOLINE AS PI3 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-07-17 | — | — | WO | disclosed |