Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.34 |
| ▸ | AKT1 | P31749 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | GLS | O94925 | 2/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.32 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12053392 | 0.87 | HDAC1 (0.41) | CTSBCTSSCTSKHDAC1BRD4 | |
| SCHEMBL1362409 | 0.86 | LMNA (0.41) | LMNAHPGD | |
| SCHEMBL3398564 | 0.81 | CHRM3 (0.41) | CHRM3TACR1HPGD | |
| SCHEMBL7217916 | 0.75 | HDAC1 (0.49) | CTSBCTSSCTSKHDAC1BRD4 | |
| SCHEMBL12053405 | 0.75 | EPHX1 (0.44) | CTSBCTSSCTSKBRD4GLS | |
| SCHEMBL12140837 | 0.74 | BRD4 (0.41) | CTSBCTSSCTSKHDAC1BRD4 | |
| SCHEMBL12053369 | 0.74 | BRD4 (0.47) | CTSBCTSSCTSKHDAC1BRD4 | |
| SCHEMBL1362144 | 0.74 | CD274 (0.41) | LMNA | |
| SCHEMBL1363398 | 0.73 | MEN1 (0.39) | LMNAHPGD | |
| SCHEMBL12053395 | 0.73 | HDAC1 (0.45) | CTSBCTSSCTSKHDAC1BRD4 |
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-8067408-B2 | Dual pharmacophores—PDE4-muscarinic antagonistics | GLAXO GROUP LIMITED (GB) | 2011-11-29 | — | — | US | disclosed |