Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 4/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | WEE1 | P30291 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7689084 | 0.79 | GRM5 (0.45) | DRD2DRD4SMN1; SMN2JAK2GRM4 | |
| SCHEMBL20117703 | 0.76 | ULK1 (0.39) | DRD2DRD4JAK2TYK2 | |
| SCHEMBL7899032 | 0.75 | FGFR2 (0.38) | DRD2DRD4MKNK1JAK2TYK2 | |
| SCHEMBL16151185 | 0.75 | EGFR (0.54) | MAPK14 | |
| SCHEMBL11557211 | 0.75 | SYK (0.50) | CA12CA1CA2CA9PDE10A | |
| SCHEMBL3694287 | 0.73 | DRD2 (0.49) | MAPK14DRD2DRD4 | |
| SCHEMBL7695744 | 0.72 | CA12 (0.68) | CA12CA1CA2CA9PDE10A | |
| SCHEMBL31219507 | 0.71 | ABCG2 (0.45) | SMN1; SMN2 | |
| SCHEMBL30269611 | 0.69 | CLK1 (0.53) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL11557056 | 0.69 | CLK1 (0.53) | CA12CA1CA2CA9SMN1; SMN2 |
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-2011163355-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-12-29 | — | — | WO | disclosed |