Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Chloromethane SCHEMBL4098077 | 0.89 | — | — | |
| SCHEMBL1801005 | 0.86 | TSHR (0.42) | KDM4ECYP3A4TSHR | |
| SCHEMBL912275 | 0.82 | CA1 (0.35) | — | |
| Tert-Butylamine SCHEMBL28669602 | 0.82 | CA1 (0.33) | — | |
| Ethane SCHEMBL27695716 | 0.78 | — | — | |
| Ethane SCHEMBL218028 | 0.78 | — | — | |
| SCHEMBL9540531 | 0.78 | — | — | |
| SCHEMBL6681816 | 0.78 | — | — | |
| SCHEMBL27986358 | 0.78 | CA5A (0.33) | KDM4ECYP3A4 | |
| SCHEMBL254 | 0.78 | — | — |
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-6821980-B1 | Substituted 5-benzyl-2,4-diaminopyrimidines | BASILEA PHARMACEUTICA AG (CH) | 2004-11-23 | — | — | US | disclosed |