Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | SYK | P43405 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 2/20 | 0.31 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | IGF1R | P08069 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | MARK3 | P27448 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL13853240 | 1.00 | PDPK1 (0.35) | PDPK1NPSR1CNR2SYKKMT2A | |
| SCHEMBL13853248 | 0.84 | CNR2 (0.35) | CNR2SYKCLK4ACVR1TAS2R14 | |
| SCHEMBL5261941 | 0.82 | CNR2 (0.36) | CNR2SYKCLK4ACVR1TAS2R14 | |
| SCHEMBL13853244 | 0.79 | TAS2R14 (0.42) | CNR2SYKCLK4ACVR1TAS2R14 | |
| SCHEMBL5314947 | 0.75 | HDAC4 (0.37) | CNR2SYKCLK4ACVR1TAS2R14 | |
| SCHEMBL5265938 | 0.73 | NOS3 (0.40) | SYKKMT2ACLK4ACVR1GSK3A | |
| SCHEMBL17608 | 0.72 | ADRB1 (0.36) | PDPK1NPSR1SYKKMT2ANPC1 | |
| SCHEMBL17609 | 0.72 | ADRB1 (0.36) | PDPK1NPSR1SYKKMT2ANPC1 | |
| SCHEMBL13853234 | 0.70 | CYP2A6 (0.40) | KMT2ANT5EMAPT | |
| SCHEMBL4187576 | 0.70 | NT5E (0.42) | SYKCLK4ACVR1TAS2R14ADORA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1824828-A2 | PYRIDINE BASED COMPOUNDS USEFUL AS INTERMEDIATES FOR PHARMACEUTICAL OR AGRICULTURAL END-PRODUCTS | Peakdale Molecular Limited (GB) | 2007-08-29 | — | — | EP | disclosed |
| WO-2006059103-A2 | PYRIDINE BASED COMPOUNDS USEFUL AS INTERMEDIATES FOR PHARMACEUTICAL OR AGRICULTURAL END-PRODUCTS | PEAKDALE MOLECULAR LIMITED (GB) | 2006-06-08 | — | — | WO | disclosed |