Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | FNTA | P49354 | 1/20 | 0.32 |
| ▸ | FNTB | P49356 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | CTSA | P10619 | 2/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | MALT1 | Q9UDY8 | 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 | |
|---|---|---|---|---|
| SCHEMBL16044201 | 0.86 | PDE4B (0.41) | PDE4BP2RX7TDO2LIMK1NUDT1 | |
| SCHEMBL16045080 | 0.85 | P2RX7 (0.44) | PDE4BP2RX7KCNA5 | |
| SCHEMBL16044366 | 0.83 | TAAR1 (0.39) | PDE4BP2RX7TDO2LIMK1NUDT1 | |
| SCHEMBL16075881 | 0.83 | PDE4B (0.39) | PDE4BP2RX7TDO2LIMK1NUDT1 | |
| SCHEMBL16044306 | 0.82 | PDE4B (0.39) | PDE4BTDO2NUDT1CTSAPDE4D | |
| SCHEMBL16044727 | 0.82 | DHFR (0.45) | PDE4BTDO2NUDT1DHFRPDE4D | |
| SCHEMBL16075879 | 0.82 | PDE4B (0.41) | PDE4BP2RX7TDO2FNTAFNTB | |
| SCHEMBL28045724 | 0.82 | PDE4B (0.42) | PDE4BP2RX7TDO2LIMK1NUDT1 | |
| SCHEMBL16047543 | 0.81 | PDE4B (0.39) | PDE4BTDO2FNTAFNTBNUDT1 | |
| SCHEMBL28604063 | 0.80 | PDE4B (0.44) | PDE4BP2RX7TDO2LIMK1NUDT1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105143207-A | Substituted pyridine and substituted pyrazine compounds as PDE4 inhibitors | DART NEUROSCIENCE LLC | 2015-12-09 | — | — | CN | disclosed |