Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.34 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19901772 | 0.75 | KDM4E (0.37) | TSHRALDH1A1 | |
| SCHEMBL21417855 | 0.71 | OPRM1 (0.33) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL14623987 | 0.71 | ALDH1A1 (0.37) | TSHRALDH1A1CYP3A4ANPEPERAP2 | |
| SCHEMBL24106668 | 0.70 | TSHR (0.44) | TSHRALDH1A1CYP3A4ANPEPERAP2 | |
| SCHEMBL9207449 | 0.69 | ALDH1A1 (0.39) | TSHRALDH1A1CYP3A4ANPEPERAP2 | |
| SCHEMBL1026117 | 0.69 | TSHR (0.46) | TSHRALDH1A1CYP3A4ANPEPERAP2 | |
| SCHEMBL23340924 | 0.69 | TSHR (0.36) | TSHRALDH1A1CYP3A4 | |
| SCHEMBL23763807 | 0.67 | TSHR (0.46) | TSHRALDH1A1CYP3A4ANPEPERAP2 | |
| SCHEMBL21162272 | 0.67 | TSHR (0.46) | TSHRALDH1A1CYP3A4ANPEPERAP2 | |
| SCHEMBL24709625 | 0.67 | TSHR (0.35) | TSHRALDH1A1 |
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-0590419-A1 | Process for preparing unsaturated amines | BASF Aktiengesellschaft (DE) | 1994-04-06 | — | — | EP | disclosed |