Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.47 |
| ▸ | PI4KA | P42356 | 3/20 | 0.47 |
| ▸ | PI4K2B | Q8TCG2 | 3/20 | 0.47 |
| ▸ | PI4K2A | Q9BTU6 | 3/20 | 0.47 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.47 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.47 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.46 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.46 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | FBP1 | P09467 | 1/20 | 0.46 |
| ▸ | SRC | P12931 | 1/20 | 0.46 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.46 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.46 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.46 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL24681005 | 0.84 | ADCY5 (0.55) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL9491956 | 0.82 | ADORA2A (0.63) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL10442802 | 0.82 | ADORA2A (0.63) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL9679986 | 0.82 | ADORA2A (0.63) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL9680440 | 0.82 | ADORA2A (0.63) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL9491498 | 0.81 | ADCY5 (0.50) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL20624558 | 0.81 | ADORA2A (0.51) | ADORA2AADORA1ADORA3PI4KAPI4K2B | |
| SCHEMBL20324638 | 0.80 | P2RY1 (0.52) | ADORA1ENPP1DNPH1PRKAB2TRPM2 | |
| SCHEMBL20325291 | 0.80 | P2RY1 (0.52) | ADORA1ENPP1DNPH1PRKAB2TRPM2 | |
| SCHEMBL22990586 | 0.80 | BCHE (0.51) | ADORA2AADORA1PI4KAPI4K2BPI4K2A |
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-2018100558-A2 | CYCLIC DINUCLEOTIDE | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-06-07 | — | — | WO | disclosed |