Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8423446 | 0.79 | — | — | |
| SCHEMBL8419617 | 0.79 | — | — | |
| SCHEMBL15368993 | 0.79 | NR1H2 (0.31) | — | |
| SCHEMBL8421137 | 0.79 | — | — | |
| SCHEMBL3956762 | 0.75 | ALDH1A1 (0.33) | ALDH1A1HSD17B10CES2CES1 | |
| SCHEMBL15914873 | 0.75 | ALDH1A1 (0.33) | ALDH1A1HSD17B10CES2CES1 | |
| SCHEMBL15914917 | 0.75 | ALDH1A1 (0.33) | ALDH1A1HSD17B10CES2CES1 | |
| SCHEMBL8423096 | 0.75 | — | — | |
| SCHEMBL8419610 | 0.75 | — | — | |
| SCHEMBL8419539 | 0.75 | — | — |
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-4363925-A | PALLADIUM COMPLEX AND A PHOSPHINE OR PHOSPHITE CATALYZED REACTION OF A DISILANE AND AN AROMATIC HALIDE | BASF AKTIENGESELLSCHAFT (DE) | 1982-12-14 | — | — | US | disclosed |