Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 9/20 | 0.76 |
| ▸ | CA1 | P00915 | 1/20 | 0.72 |
| ▸ | CA2 | P00918 | 1/20 | 0.72 |
| ▸ | CA4 | P22748 | 1/20 | 0.72 |
| ▸ | CA9 | Q16790 | 1/20 | 0.72 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.69 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.69 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.69 |
| ▸ | PDE2A | O00408 | 1/20 | 0.67 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.67 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.67 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.67 |
| ▸ | NT5E | P21589 | 2/20 | 0.66 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | P2RY1 | P47900 | 3/20 | 0.63 |
| ▸ | DNMT1 | P26358 | 2/20 | 0.63 |
| ▸ | P2RY11 | Q96G91 | 2/20 | 0.63 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.63 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL5353996 | 1.00 | ADORA3 (0.76) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL5354005 | 1.00 | ADORA3 (0.76) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL13860353 | 1.00 | ADORA3 (0.76) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL1663268 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL1389446 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL13863559 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL397323 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL6886946 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL104095 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 | |
| SCHEMBL104094 | 0.91 | ADORA3 (0.81) | ADORA3CA1CA2CA4CA9 |
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-2012159072-A2 | FLUORESCENT MOLECULAR PROBES FOR USE IN ASSAYS THAT MEASURE TEST COMPOUND COMPETITIVE BINDING WITH SAM-UTILIZING PROTEINS | CAYMAN CHEMICAL COMPANY, INCORPORATED (US) | 2012-11-22 | — | — | WO | disclosed |