Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.33 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 2/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL8778585 | 0.84 | CAMKK2 (0.33) | MALT1CAMKK2PLA2G2DNQO1ABL1 | |
| SCHEMBL5020167 | 0.74 | PLA2G2D (0.32) | PLA2G2DMLYCD | |
| SCHEMBL16914971 | 0.65 | L3MBTL1 (0.44) | CAMKK2NQO1PDE4APDE4BPDE4C | |
| SCHEMBL16915197 | 0.65 | NQO1 (0.41) | CAMKK2NQO1PDE4APDE4BPDE4C | |
| SCHEMBL31253334 | 0.65 | SOS2 (0.41) | CAMKK2CTSBMAPK1 | |
| SCHEMBL31324958 | 0.65 | SOS2 (0.41) | CAMKK2CTSBMAPK1 | |
| SCHEMBL838145 | 0.65 | ALDH1A1 (0.41) | CAMKK2CTSB | |
| SCHEMBL25873382 | 0.64 | NQO1 (0.40) | NQO1CTSB | |
| SCHEMBL8745729 | 0.64 | NOTUM (0.39) | MALT1NQO1CTSBPDE4APDE4B | |
| SCHEMBL25585924 | 0.63 | NAPRT (0.43) | CAMKK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012064943-A2 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2012-05-18 | — | — | WO | disclosed |