Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 1/20 | 0.30 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.30 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| SCHEMBL27742729 | 1.00 | SCN1A (0.30) | SCN1ASCN2ASCN3A | |
| SCHEMBL27721977 | 1.00 | SCN1A (0.30) | SCN1ASCN2ASCN3A | |
| SCHEMBL28776242 | 0.92 | DRD3 (0.30) | — | |
| SCHEMBL28290453 | 0.85 | SCN1A (0.34) | SCN1ASCN2ASCN3A | |
| SCHEMBL28058839 | 0.85 | DRD3 (0.31) | — | |
| SCHEMBL28058929 | 0.85 | DRD3 (0.31) | — | |
| SCHEMBL27721983 | 0.83 | — | — | |
| SCHEMBL28289023 | 0.82 | DRD3 (0.37) | — | |
| SCHEMBL28055328 | 0.81 | SIGMAR1 (0.39) | — | |
| SCHEMBL28055265 | 0.81 | HSD11B1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101309918-B | [4-(benzo[b]thiophen-2-yl)-pyrimidin-2-yl]-amine derivatives as ikk-beta inhibitors for the treatment of cancer and inflammatory diseases | LILLY CO ELI | 2010-12-29 | — | — | CN | disclosed |
| CN-101309918-A | [4-(benzo[b]thiophen-2-yl)-pyrimidin-2-yl]-amine derivatives as ikk-beta inhibitors for the treatment of cancer and inflammatory diseases | LILLY CO ELI (US) | 2008-11-19 | — | — | CN | disclosed |