Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10028946 | 0.93 | ALDH1A1 (0.39) | ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL14532392 | 0.87 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL881172 | 0.85 | ALDH1A1 (0.45) | ALDH1A1 | |
| SCHEMBL28604151 | 0.83 | ALDH1A1 (0.43) | ALDH1A1 | |
| SCHEMBL7890530 | 0.80 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL21923846 | 0.77 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL18901561 | 0.76 | — | — | |
| SCHEMBL8587354 | 0.74 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL18023104 | 0.74 | ALDH1A1 (0.35) | ALDH1A1TSHR | |
| SCHEMBL13323600 | 0.74 | ACACB (0.48) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2429568-B1 | MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARM INC (US) | 2016-08-17 | — | — | EP | disclosed |