Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.38 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9079845 | 0.98 | ALDH1A1 (0.44) | TSHRALDH1A1AOC3SMN1; SMN2NPC1 | |
| SCHEMBL9178257 | 0.87 | TSHR (0.47) | TSHRALDH1A1AOC3SMN1; SMN2NPC1 | |
| SCHEMBL8497182 | 0.82 | CYP1A2 (0.49) | TSHRALDH1A1SMN1; SMN2HTR1ADRD2 | |
| SCHEMBL8497082 | 0.82 | MAPT (0.47) | TSHRALDH1A1SMN1; SMN2MAPK1KMT2A | |
| SCHEMBL7760999 | 0.82 | TRPM8 (0.44) | TSHRALDH1A1SMN1; SMN2CHRM2CHRM1 | |
| SCHEMBL28458578 | 0.77 | TSHR (0.43) | TSHRALDH1A1AOC3SMN1; SMN2NPC1 | |
| SCHEMBL12476817 | 0.77 | TSHR (0.52) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL8498728 | 0.77 | BCHE (0.39) | TSHRALDH1A1AOC3SMN1; SMN2NPC1 | |
| SCHEMBL8496296 | 0.77 | OPRM1 (0.44) | NPC1RAB9AOPRM1OPRD1 | |
| SCHEMBL8496481 | 0.76 | TSHR (0.44) | TSHRALDH1A1AOC3SMN1; SMN2NPC1 |
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-1996034851-A1 | BENZENE, PYRIDINE, NAPHTALENE OR BENZOPHENONE DERIVATIVES AS INHIBITORS OF SQUALENE SYNTHETASE AND PROTEIN FARNESYLTRANSFERASE | ABBOTT LABORATORIES (US) | 1996-11-07 | — | — | WO | disclosed |