Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | LPL | P06858 | 8/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 8/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | F11 | P03951 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3263042 | 0.80 | LTA4H (0.42) | CYP2D6ESR2LPLLIPG | |
| SCHEMBL3261417 | 0.80 | LTA4H (0.42) | CYP2D6ESR2LPLLIPG | |
| SCHEMBL3262944 | 0.80 | LTA4H (0.42) | CYP2D6ESR2LPLLIPG | |
| SCHEMBL3261902 | 0.78 | ESR2 (0.41) | ESR2LPLLIPGF11 | |
| SCHEMBL3228738 | 0.76 | KCNA5 (0.51) | KCNA5CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL12508295 | 0.76 | KCNA5 (0.71) | KCNA5CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL3227247 | 0.71 | LPL (0.41) | ESR2LPLLIPGFFAR1F11 | |
| SCHEMBL138606 | 0.71 | LPL (0.47) | HTTLPLLIPG | |
| SCHEMBL24933207 | 0.71 | ESR2 (0.35) | KCNA5HTTESR2KCNH2LPL | |
| SCHEMBL20640002 | 0.70 | ESR2 (0.39) | ESR2LPLLIPGFFAR1F11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010010184-A1 | [1, 2, 4] TRIAZOLO [1, 5-A] PYRIDINES AS JAK INHIBITORS | GALAPAGOS NV (BE) | 2010-01-28 | — | — | WO | disclosed |
| WO-2010010184-A1 | [1, 2, 4] TRIAZOLO [1, 5-A] PYRIDINES AS JAK INHIBITORS | GALAPAGOS NV (BE) | 2010-01-28 | — | — | WO | disclosed |