Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | EDNRA | P25101 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4093857 | 0.78 | ALDH1A1 (0.41) | ALDH1A1GPR35GSK3BTSHRKDM4E | |
| SCHEMBL4584130 | 0.73 | GSK3B (0.59) | GPR35GSK3BTSHRDAOPOLB | |
| SCHEMBL6286677 | 0.72 | — | — | |
| SCHEMBL9728565 | 0.69 | LMNA (0.62) | TSHRKDM4ELMNANPSR1EDNRA | |
| SCHEMBL2690137 | 0.68 | POLB (0.52) | ALDH1A1GPR35GSK3BTSHRKDM4E | |
| SCHEMBL11538318 | 0.68 | GPR35 (0.37) | ALDH1A1GPR35TSHRKDM4EGAA | |
| Hydrochloric Acid SCHEMBL11485444 | 0.68 | LMNA (0.61) | TSHRKDM4ELMNANPSR1EDNRA | |
| SCHEMBL11486082 | 0.68 | DAO (0.34) | ALDH1A1GPR35TSHRKDM4EGAA | |
| SCHEMBL1326886 | 0.67 | KDM4E (0.68) | ALDH1A1GPR35TSHRKDM4EGAA | |
| SCHEMBL1327549 | 0.67 | KDM4E (0.45) | ALDH1A1GPR35TSHRKDM4EGAA |
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-A | Cyclic sulfamoyl arylamide derivatives and their use as medicaments for the treatment of hepatitis B | 爱尔兰詹森科学公司 | 2018-02-23 | — | — | CN | disclosed |