Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.44 |
| ▸ | SCD5 | Q86SK9 | 7/20 | 0.43 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | NOS3 | P29474 | 3/20 | 0.40 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL901734 | 0.83 | HTT (0.46) | — | |
| SCHEMBL29668662 | 0.79 | HTR1A (0.50) | NOS1NOS3 | |
| SCHEMBL901843 | 0.78 | ASIC3 (0.46) | ASIC3SCD5NOS1NOS3SCD | |
| SCHEMBL4615095 | 0.77 | NPC1 (0.45) | SCD5NPC1 | |
| SCHEMBL901665 | 0.76 | KARS1 (0.53) | SCD5SCD | |
| SCHEMBL901929 | 0.75 | KARS1 (0.55) | — | |
| SCHEMBL902923 | 0.74 | NPC1 (0.36) | HSD11B1SCD5NPC1MCHR1 | |
| SCHEMBL901953 | 0.73 | KARS1 (0.56) | — | |
| SCHEMBL1558037 | 0.73 | DRD2 (0.58) | — | |
| SCHEMBL23360547 | 0.72 | SCD5 (0.53) | HSD11B1SCD5SCDNPC1 |
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-2441755-A1 | Pyridine- and isoquinoline-derivatives as Syk and JAK kinase inhibitors | Almirall, S.A. (ES) | 2012-04-18 | — | — | EP | disclosed |
| WO-2012041476-A1 | PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS | ALMIRALL, S.A. (ES) | 2012-04-05 | — | — | WO | disclosed |