Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | HPGDS | O60760 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22733818 | 0.80 | CES2 (0.45) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL11168232 | 0.77 | RECQL (0.43) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL1172994 | 0.77 | CES2 (0.42) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL11168229 | 0.77 | RECQL (0.43) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL18010217 | 0.76 | CES2 (0.41) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL18010159 | 0.72 | PDE4A (0.45) | CES2CES1DAORAB9AMEN1 | |
| SCHEMBL5639979 | 0.69 | — | — | |
| SCHEMBL11198155 | 0.69 | CES2 (0.50) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL11198165 | 0.69 | CES2 (0.50) | CES2CES1DAOGSK3BRAB9A | |
| SCHEMBL16515993 | 0.68 | PDE4A (0.39) | CES2CES1DAORAB9ANPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4326436-A1 | MOF, MOF LINKERS AND MANUFACTURING METHOD THEREOF | Universiteit Antwerpen (BE) | 2024-02-28 | — | — | EP | disclosed |
| WO-2022223773-A1 | MOF, MOF LINKERS AND MANUFACTURING METHOD THEREOF | UNIVERSITEIT ANTWERPEN (BE) | 2022-10-27 | — | — | WO | disclosed |