Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | RICTOR | Q6R327 | 1/20 | 0.37 |
| ▸ | RPTOR | Q8N122 | 1/20 | 0.37 |
| ▸ | MAPKAP1 | Q9BPZ7 | 1/20 | 0.37 |
| ▸ | MLST8 | Q9BVC4 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 10/20 | 0.36 |
| ▸ | TNK2 | Q07912 | 3/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.36 |
| ▸ | PDE1A | P54750 | 2/20 | 0.35 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | IGF1R | P08069 | 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 | |
|---|---|---|---|---|
| SCHEMBL19264032 | 0.92 | PIK3CA (0.42) | PIK3CAPIK3CBMTORPIK3CGPRKDC | |
| SCHEMBL25277153 | 0.92 | PIK3CA (0.42) | PIK3CAPIK3CBMTORPIK3CGPRKDC | |
| SCHEMBL17893109 | 0.86 | TNK2 (0.39) | BTKTNK2PDE1CPDE1APDE1B | |
| SCHEMBL17892473 | 0.86 | TNK2 (0.39) | BTKTNK2PDE1CPDE1APDE1B | |
| SCHEMBL16748877 | 0.82 | PDE1C (0.44) | TNK2PDE1CPDE1APDE1B | |
| SCHEMBL8399329 | 0.82 | PDE1C (0.37) | PIK3CAPIK3CBMTORPIK3CGPRKDC | |
| SCHEMBL17893392 | 0.81 | CYP2C19 (0.37) | PIK3CAPIK3CBMTORPIK3CGPRKDC | |
| SCHEMBL17892667 | 0.81 | PDE1C (0.33) | TNK2PDE1CPDE1APDE1B | |
| SCHEMBL17892665 | 0.81 | PDE1C (0.33) | TNK2PDE1CPDE1APDE1B | |
| SCHEMBL397860 | 0.81 | TNK2 (0.44) | PIK3CAPIK3CBMTORPIK3CGPRKDC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3240572-B1 | BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS | MERCK SHARP & DOHME LLC (US) | 2023-11-01 | — | — | EP | disclosed |
| EP-3240572-A1 | BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2017-11-08 | — | — | EP | disclosed |
| WO-2016109223-A1 | BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-07-07 | — | — | WO | disclosed |