Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 4/20 | 0.42 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.40 |
| ▸ | BIRC2 | Q13490 | 4/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19699476 | 0.82 | XIAP (0.39) | XIAPBIRC2ADORA2AADORA3ADORA1 | |
| SCHEMBL29329931 | 0.73 | SMN1; SMN2 (0.40) | GSK3AGSK3BADORA2ASRCALDH1A1 | |
| SCHEMBL18237704 | 0.72 | PARP1 (0.42) | GSK3AGSK3BADORA2ASRCALDH1A1 | |
| SCHEMBL1965199 | 0.70 | ADORA3 (0.43) | XIAPBIRC2ADORA2AADORA3ADORA1 | |
| SCHEMBL19153800 | 0.70 | PARP1 (0.50) | ADORA2AADORA1SRCALDH1A1RAB9A | |
| SCHEMBL735411 | 0.69 | GDA (0.72) | GDAXDH | |
| SCHEMBL30979186 | 0.66 | PARP1 (0.46) | GSK3AGSK3BADORA2ASRCALDH1A1 | |
| SCHEMBL21808624 | 0.66 | PARP1 (0.46) | GSK3AGSK3BADORA2ASRCALDH1A1 | |
| SCHEMBL21339749 | 0.66 | SRC (0.52) | ADORA2AADORA1SRCALDH1A1RAB9A | |
| SCHEMBL17776531 | 0.65 | GDA (0.46) | GDAADORA3ADORA1KDM4ELMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3854799-B1 | CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION | SHANGHAI DE NOVO PHARMATECH CO LTD (CN) | 2024-07-17 | — | — | EP | disclosed |
| EP-3854799-A1 | CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION | Shanghai de Novo Pharmatech Co., Ltd. (CN) | 2021-07-28 | — | — | EP | disclosed |
| WO-2020057546-A1 | CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION | 上海迪诺医药科技有限公司 | 2020-03-26 | — | — | WO | disclosed |