Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | AGXT | P21549 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | BCL2 | P10415 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL1573022 | 0.81 | ADORA1 (0.39) | ADORA2AADORA1TDP1PTGS2SMN1; SMN2 | |
| SCHEMBL2084657 | 0.78 | PDE4A (0.44) | ADORA2AADORA1PTGS2SMN1; SMN2NR1H2 | |
| SCHEMBL2085307 | 0.77 | PDE4A (0.55) | PTGS2PTGS1 | |
| SCHEMBL3397783 | 0.76 | PTGS2 (0.40) | ADORA1PTGS2SMN1; SMN2MAPTPTGS1 | |
| SCHEMBL13744894 | 0.75 | SMN1; SMN2 (0.36) | ADORA2AADORA2BADORA1PTGS2SMN1; SMN2 | |
| SCHEMBL27750194 | 0.74 | PTGS2 (0.34) | ADORA2AADORA1TDP1PTGS2SMN1; SMN2 | |
| SCHEMBL1573250 | 0.74 | KDM4E (0.42) | ADORA2APTGS2SMN1; SMN2MAPTPTGS1 | |
| SCHEMBL1572913 | 0.73 | PTGS2 (0.57) | PTGS2PTGS1 | |
| SCHEMBL1572984 | 0.72 | L3MBTL1 (0.45) | ADORA2AADORA2BADORA1TDP1PTGS2 | |
| SCHEMBL2084879 | 0.72 | PTGS2 (0.46) | PTGS2PTGS1 |
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-2009095773-A2 | NOVEL HETEROCYCLES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2009-08-06 | — | — | WO | disclosed |