Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15718693 | 0.81 | CSNK2A2 (0.39) | CSNK2A2CSNK2BCSNK2A1ADORA2AADORA1 | |
| SCHEMBL14980110 | 0.74 | ADORA2A (0.47) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL441875 | 0.63 | ADORA1 (0.62) | ADORA2AADORA1ADORA2BPI4KAPI4K2B | |
| SCHEMBL12843977 | 0.63 | ADORA2A (0.32) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL12843974 | 0.63 | ADORA3 (0.51) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL19003189 | 0.62 | — | — | |
| SCHEMBL12359852 | 0.62 | HPGD (0.40) | CSNK2A2CSNK2BCSNK2A1ALOX15HTT | |
| SCHEMBL14438668 | 0.62 | TP53 (0.50) | ADORA2AADORA1PI4KAPI4K2BPI4K2A | |
| SCHEMBL569037 | 0.61 | RAB9A (0.57) | ALOX15HTTPOLBCYP1A2TSHR | |
| SCHEMBL24122008 | 0.61 | CHRM4 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4180576-A | Purines useful for the potentiation of antibiotics | COMMONWEALTH SCIENTIFIC INDUSTRIAL RESEARCH ORGANIZATION (AU) | 1979-12-25 | — | — | US | disclosed |