Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL16766115 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNAADRB2ADRB1 | |
| SCHEMBL14627093 | 0.89 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNAADRB2ADRB1 | |
| SCHEMBL935021 | 0.89 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNAADRB2ADRB1 | |
| SCHEMBL14346454 | 0.85 | ALDH1A1 (0.43) | ALDH1A1MAPTADRB2ADRB1ADRB3 | |
| SCHEMBL14656603 | 0.85 | ALDH1A1 (0.43) | ALDH1A1MAPTADRB2ADRB1ADRB3 | |
| SCHEMBL14346455 | 0.85 | ALDH1A1 (0.43) | ALDH1A1MAPTADRB2ADRB1ADRB3 | |
| SCHEMBL933933 | 0.85 | ALDH1A1 (0.40) | ALDH1A1MAPTLMNAADRB2ADRB1 | |
| SCHEMBL14626985 | 0.82 | KCNJ1 (0.44) | ALDH1A1MAPTLMNAPOLBKCNJ1 | |
| SCHEMBL933956 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MAPTLMNAADRB2ADRB1 | |
| SCHEMBL933960 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MAPTLMNAADRB2ADRB1 |
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-3533797-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2023-12-20 | — | — | EP | disclosed |