Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | GRK6 | P43250 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.35 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.35 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 9/20 | 0.35 |
| ▸ | JAK2 | O60674 | 10/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11900736 | 0.80 | CYP11B2 (0.38) | CYP11B2GRK6GABRPGABRDGABRA1 | |
| SCHEMBL12472653 | 0.80 | JAK1 (0.36) | CYP11B2JAK1JAK2TYK2JAK3 | |
| SCHEMBL12472196 | 0.79 | JAK2 (0.37) | JAK1JAK2TYK2JAK3 | |
| SCHEMBL12472212 | 0.78 | HPGD (0.41) | PLA2G2A | |
| Hydrochloric Acid SCHEMBL12472209 | 0.77 | HPGD (0.40) | PLA2G2A | |
| Hydrochloric Acid SCHEMBL12472818 | 0.77 | HPGD (0.40) | PLA2G2A | |
| SCHEMBL11900868 | 0.72 | GFER (0.34) | CYP11B2JAK1JAK2TYK2JAK3 | |
| SCHEMBL12265549 | 0.71 | GRK6 (0.39) | GRK6 | |
| SCHEMBL11900807 | 0.69 | PIK3CD (0.42) | JAK1 | |
| SCHEMBL21390890 | 0.67 | PLA2G1B (0.33) | JAK1JAK2IDH1 |
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-2673269-A1 | HETEROCYCLIC COMPOUNDS AS PI3 KINASE INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2013-12-18 | — | — | EP | disclosed |
| WO-2012107465-A1 | HETEROCYCLIC COMPOUNDS AS PI3 KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-08-16 | — | — | WO | disclosed |