Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.47 |
| ▸ | FAAH | O00519 | 3/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.45 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL144712 | 0.87 | ALDH1A1 (0.48) | CES1FAAHSMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL11143285 | 0.83 | MAOB (0.50) | CES1FAAHSMN1; SMN2ALDH1A1FFAR1 | |
| SCHEMBL8905009 | 0.81 | BLM (0.44) | CES1FAAHKEAP1LMNASMN1; SMN2 | |
| Carbamic Acid SCHEMBL2222080 | 0.80 | FFAR1 (0.62) | CES1KEAP1LMNASMN1; SMN2HDAC2 | |
| SCHEMBL27868817 | 0.80 | FAAH (0.42) | CES1FAAHLMNAALDH1A1POLB | |
| SCHEMBL11141383 | 0.79 | CALM1 (0.52) | CES1LMNASMN1; SMN2ALDH1A1CYP2A6 | |
| Carbamic Acid SCHEMBL8092472 | 0.78 | FFAR1 (0.60) | CES1KEAP1LMNASMN1; SMN2HDAC2 | |
| SCHEMBL4134393 | 0.78 | CES1 (0.49) | CES1FAAHKEAP1GRM2GRM3 | |
| SCHEMBL7405858 | 0.77 | KEAP1 (0.53) | CES1FAAHKEAP1SMN1; SMN2HDAC2 | |
| SCHEMBL27957913 | 0.77 | AR (0.47) | CES1FAAHKEAP1LMNAGRM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023193733-A1 | AT2R AGONIST | 武汉人福创新药物研发中心有限公司 | 2023-10-12 | — | — | WO | disclosed |