Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | PRNP | P04156 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | AXL | P30530 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
| ▸ | PDPK1 | O15530 | 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 | |
|---|---|---|---|---|
| SCHEMBL17875703 | 0.81 | PDPK1 (0.36) | HTTADORA2AADORA2BPRNPAXL | |
| SCHEMBL14752195 | 0.78 | TRPA1 (0.35) | HTTADORA2AADORA2BCHEK1MEN1 | |
| SCHEMBL26027288 | 0.74 | PDPK1 (0.34) | ADORA2AADORA2BMEN1PRNPKMT2A | |
| SCHEMBL28492876 | 0.74 | HCAR2 (0.40) | MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL17875705 | 0.72 | JAK2 (0.49) | — | |
| SCHEMBL27192096 | 0.69 | ADORA2A (0.34) | ADORA2AADORA2BCYP1A2 | |
| SCHEMBL30702001 | 0.69 | ADORA2A (0.34) | ADORA2AADORA2BCYP1A2 | |
| SCHEMBL6830412 | 0.69 | PDPK1 (0.43) | CHEK1MEN1KMT2AAXLDYRK1A | |
| SCHEMBL26364773 | 0.69 | GRIN2D (0.34) | ADORA2AADORA2BMEN1PRNPKMT2A | |
| SCHEMBL24652846 | 0.68 | ADORA2A (0.33) | ADORA2AADORA2BDYRK1ACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107556244-B | Fused ring compound, pharmaceutical composition and application thereof | 上海迪诺医药科技有限公司 | 2021-09-03 | — | — | CN | disclosed |