Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7019949 | 0.84 | DRD1 (0.34) | ALDH1A1MAPTATMDRD1KCNH2 | |
| SCHEMBL9764406 | 0.66 | USP2 (0.33) | — | |
| SCHEMBL7018587 | 0.65 | DRD1 (0.36) | DRD1KCNH2HSD11B1 | |
| SCHEMBL25334488 | 0.62 | ALDH1A1 (0.46) | ALDH1A1MAPTATMDRD1KCNH2 | |
| SCHEMBL3653106 | 0.62 | HPGD (0.30) | — | |
| SCHEMBL7019620 | 0.62 | DRD1 (0.35) | ALDH1A1MAPTATMDRD1KCNH2 | |
| SCHEMBL7019619 | 0.62 | DRD1 (0.35) | ALDH1A1MAPTATMDRD1KCNH2 | |
| SCHEMBL9493836 | 0.62 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL7023359 | 0.61 | DRD1 (0.37) | ALDH1A1MAPTATMDRD1KCNH2 | |
| SCHEMBL7023357 | 0.61 | DRD1 (0.37) | ALDH1A1MAPTATMDRD1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6479435-B1 | OR DIARYL SULFIDES, 1-(4-CHLORO-2-FLUORO-5-(2-PYRIMIDYLOXY)PHENYL)-4-DIFLUOROMETHY L-3-METHYL-1,4-DIHYDRO-1,2,4-TRIAZOLIN-5-ONE FOR EXAMPLE | ISK AMERICAS INCORPORATED | 2002-11-12 | — | — | US | disclosed |