Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15743897 | 0.82 | BRD4 (0.48) | BRD4NPC1JAK1JAK3 | |
| SCHEMBL15911927 | 0.77 | BRD4 (0.33) | BRD4NPC1 | |
| SCHEMBL10283759 | 0.69 | MMP12 (0.49) | NPC1 | |
| SCHEMBL16601576 | 0.69 | GABRG2 (0.34) | — | |
| SCHEMBL8265565 | 0.67 | MMP12 (0.50) | BRD4NPC1JAK1JAK3 | |
| SCHEMBL15786403 | 0.66 | MARK3 (0.31) | — | |
| SCHEMBL12179234 | 0.66 | MAP3K11 (0.52) | — | |
| SCHEMBL22096126 | 0.66 | NPC1 (0.34) | NPC1 | |
| SCHEMBL16946151 | 0.65 | BRD4 (0.43) | BRD4 | |
| SCHEMBL18580604 | 0.65 | BRD4 (0.47) | BRD4NPC1JAK1JAK3 |
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-8993585-B2 | Cyclic amine substituted pyrimidinediamines as PKC inhibitors | RIGEL PHARMACEUTICALS, INC. (US) | 2015-03-31 | — | — | US | disclosed |