Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL12061418 | 0.82 | — | — | |
| SCHEMBL59271 | 0.82 | — | — | |
| SCHEMBL12062511 | 0.82 | — | — | |
| SCHEMBL8863287 | 0.78 | TSHR (0.90) | TSHRALDH1A1 | |
| SCHEMBL20676885 | 0.78 | TSHR (0.90) | TSHRALDH1A1 | |
| SCHEMBL4451292 | 0.78 | ALDH1A1 (0.62) | TSHRALDH1A1 | |
| SCHEMBL214876 | 0.78 | — | — | |
| Cyanide SCHEMBL27742508 | 0.73 | — | — | |
| SCHEMBL14514232 | 0.72 | — | — | |
| SCHEMBL29110898 | 0.71 | TSHR (0.74) | TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1713766-A1 | METHOD FOR THE SEPARATION OF PENTENENITRILE ISOMERS | BASF Aktiengesellschaft (DE) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005073179-A1 | METHOD FOR THE SEPARATION OF PENTENENITRILE ISOMERS | BASF AKTIENGESELLSCHAFT (DE) | 2005-08-11 | — | — | WO | disclosed |