Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.40 |
| ▸ | SLC29A1 | Q99808 | 4/20 | 0.35 |
| ▸ | HK1 | P19367 | 1/20 | 0.35 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2995163 | 0.90 | ADORA2A (0.35) | CYP1A2CYP2C19CYP2C9HIF1ACYP3A4 | |
| SCHEMBL3001864 | 0.87 | CYP1A2 (0.39) | CYP1A2CYP3A4SLC29A1ADORA2AADORA1 | |
| SCHEMBL2996929 | 0.84 | CYP1A2 (0.40) | CYP1A2CYP2C19CYP2C9HIF1ACYP3A4 | |
| SCHEMBL3005664 | 0.82 | CCNE1 (0.49) | SLC29A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL2999182 | 0.81 | CCNE1 (0.36) | SLC29A1CDK1CCNB1CCNE1CDK2 | |
| SCHEMBL2909064 | 0.80 | CYP1A2 (0.38) | CYP1A2CYP2C19CYP2C9HIF1ACYP3A4 | |
| SCHEMBL2995698 | 0.79 | HSP90AB1 (0.42) | CDK1CCNB1CCNE1CDK2 | |
| SCHEMBL3000253 | 0.78 | PDE4A (0.38) | CYP1A2SLC29A1CYP2D6PDE4APDE4B | |
| SCHEMBL2991772 | 0.78 | ADORA2A (0.35) | CYP1A2CYP2C19CYP2C9HIF1ACYP3A4 | |
| SCHEMBL2911646 | 0.77 | CYP1A2 (0.41) | CYP1A2CYP2C19CYP2C9HIF1ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1358198-B1 | NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME | LG LIFE SCIENCES LTD (KR) | 2010-08-25 | — | — | EP | claimed |