Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.35 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.35 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30017695 | 0.79 | KCNN4 (0.42) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL1239429 | 0.79 | KCNN4 (0.42) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL3674130 | 0.79 | KCNN4 (0.42) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL12980626 | 0.79 | KCNN4 (0.38) | KCNN4SLC22A12KCNE1KCNQ1HDAC3 | |
| SCHEMBL14690376 | 0.79 | KCNN4 (0.38) | KCNN4SLC22A12KCNE1KCNQ1HDAC3 | |
| Hydrochloric Acid SCHEMBL26916930 | 0.77 | KCNN4 (0.41) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL2525080 | 0.77 | KCNN4 (0.44) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL20076543 | 0.77 | ACHE (0.42) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL11415516 | 0.77 | ACHE (0.42) | KCNN4ACHESLC22A12KCNE1KCNQ1 | |
| SCHEMBL15903165 | 0.76 | KCNN4 (0.36) | KCNN4KCNE1KCNQ1HDAC3HDAC1 |
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-2709992-A1 | 1,3-OXAZINES AS BACE1 AND/OR BACE2 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2014-03-26 | — | — | EP | disclosed |
| WO-2012156284-A1 | 1,3-OXAZINES AS BACE1 AND/OR BACE2 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-11-22 | — | — | WO | disclosed |