Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 6/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 6/20 | 0.38 |
| ▸ | TYMS | P04818 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 5/20 | 0.34 |
| ▸ | ATR | Q13535 | 2/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4741116 | 0.89 | DHFR (0.40) | TYMSADORA2AADORA1PTGS2 | |
| SCHEMBL4741246 | 0.82 | TYMS (0.42) | TYMSADORA2AADORA1 | |
| SCHEMBL4741251 | 0.82 | ADORA2A (0.43) | TYMSADORA2AADORA1MAPK10 | |
| SCHEMBL4740434 | 0.81 | ADORA2A (0.51) | TYMSADORA2AADORA1 | |
| SCHEMBL4736827 | 0.81 | CCR2 (0.40) | — | |
| SCHEMBL4738543 | 0.80 | MAP2K4 (0.41) | TYMSATRMAPK8MAPK10 | |
| SCHEMBL4737740 | 0.78 | ADORA2A (0.46) | TYMSADORA2AADORA1 | |
| SCHEMBL4741259 | 0.77 | TYMS (0.41) | TYMSADORA2AADORA1 | |
| SCHEMBL4740757 | 0.76 | PIK3CD (0.39) | TYMSADORA2AADORA1 | |
| SCHEMBL4740440 | 0.76 | TYMS (0.41) | TYMSADORA2AADORA1 |
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-2008086158-A1 | BENZODIHYDROQUINAZOLINE AS PI3 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-07-17 | — | — | WO | disclosed |