Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 10/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | ACLY | P53396 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | FABP4 | P15090 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | GHSR | Q92847 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1377353 | 0.96 | HTR6 (0.47) | HTR6HSD11B1ACLYKEAP1FABP4 | |
| SCHEMBL1378313 | 0.84 | HTR6 (0.49) | HTR6KEAP1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL1380982 | 0.82 | HTR6 (0.57) | HTR6MAPTMCL1CYP1A2HTR1A | |
| SCHEMBL1381024 | 0.82 | HTR6 (0.59) | HTR6MAPTHTR1A | |
| Hydrochloric Acid SCHEMBL6047112 | 0.81 | HTR6 (0.56) | HTR6ALDH1A1MAPTMCL1CYP1A2 | |
| SCHEMBL1380554 | 0.81 | KEAP1 (0.56) | HTR6KEAP1ALDH1A1MAPTHTR1A | |
| SCHEMBL1377720 | 0.79 | HTR6 (0.53) | HTR6ACLYKEAP1ALDH1A1L3MBTL1 | |
| SCHEMBL1380560 | 0.79 | HTR6 (0.53) | HTR6ALDH1A1MAPTMCL1HTR1A | |
| SCHEMBL1377080 | 0.79 | ALDH1A1 (0.52) | HTR6ACLYKEAP1ALDH1A1POLB | |
| SCHEMBL1377282 | 0.78 | HTR6 (0.55) | HTR6ALDH1A1POLBCYP1A2HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| JP-4731114-B2 | — | — | 2011-07-20 | — | — | JP | claimed |