Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13998645 | 0.85 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1KDM4EGAAMAPT | |
| SCHEMBL5040778 | 0.82 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1KDM4EGAAMAPT | |
| SCHEMBL2600059 | 0.78 | ALDH1A1 (0.61) | ALDH1A1L3MBTL1KDM4EGAAMAPT | |
| SCHEMBL28525470 | 0.75 | RECQL (0.56) | SLC6A2HTR2ASLC6A4HRH1HTR2B | |
| SCHEMBL3084797 | 0.73 | ALDH1A1 (0.64) | ALDH1A1NPC1RAB9AL3MBTL1KDM4E | |
| SCHEMBL141241 | 0.72 | FDPS (0.47) | ALDH1A1POLBSLC6A2HTR2ASLC6A4 | |
| SCHEMBL9422769 | 0.72 | FDPS (0.47) | ALDH1A1POLBSLC6A2HTR2ASLC6A4 | |
| SCHEMBL9130780 | 0.72 | FDPS (0.47) | ALDH1A1POLBSLC6A2HTR2ASLC6A4 | |
| SCHEMBL27578810 | 0.72 | ALDH1A1 (0.57) | ALDH1A1NPC1POLBRAB9AL3MBTL1 | |
| SCHEMBL453717 | 0.72 | — | — |
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-107735400-B | Cyclic sulfamoyl arylamide derivatives and their use as medicaments for the treatment of hepatitis B | 爱尔兰詹森科学公司 | 2021-02-02 | — | — | CN | disclosed |