Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 4/20 | 0.46 |
| ▸ | KCNK9 | Q9NPC2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | F2R | P25116 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.38 |
| ▸ | HCN1 | O60741 | 1/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14127333 | 0.84 | KCNK3 (0.48) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL2334101 | 0.82 | ADRA2A (0.40) | KCNK3KCNK9ALDH1A1ADRA2AADRA2B | |
| SCHEMBL6722687 | 0.82 | KCNK3 (0.43) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL12954616 | 0.81 | KCNK3 (0.42) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL1286691 | 0.81 | KCNK3 (0.56) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL20683623 | 0.80 | F2R (0.44) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL23761699 | 0.78 | ANO1 (0.44) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL20693195 | 0.78 | KCNK3 (0.41) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 | |
| SCHEMBL7188551 | 0.77 | HTT (0.47) | ALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL2096726 | 0.77 | KCNK3 (0.49) | KCNK3KCNK9ALDH1A1L3MBTL1CYP11B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023215801-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | KUMQUAT BIOSCIENCES INC. (US) | 2023-11-09 | — | — | WO | disclosed |
| WO-2019160813-A1 | ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2019-08-22 | — | — | WO | disclosed |
| WO-2017201150-A1 | ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2017-11-23 | — | — | WO | disclosed |