Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 4/20 | 0.42 |
| ▸ | KCNK9 | Q9NPC2 | 4/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | F2R | P25116 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | PNLIP | P16233 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 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 | |
|---|---|---|---|---|
| SCHEMBL351860 | 0.81 | CTNNB1 (0.55) | KCNK3KCNK9HSD11B1RXFP1CYP11B1 | |
| SCHEMBL3625287 | 0.81 | KCNK3 (0.42) | KCNK3KCNK9GRIN2BGRIN1HSD11B1 | |
| SCHEMBL16400804 | 0.81 | KCNK3 (0.42) | KCNK3KCNK9HSD11B1RXFP1CYP11B1 | |
| SCHEMBL29710969 | 0.81 | CTNNB1 (0.55) | KCNK3KCNK9HSD11B1RXFP1CYP11B1 | |
| Hydrochloric Acid SCHEMBL23497848 | 0.79 | KCNK3 (0.41) | KCNK3KCNK9GRIN2BGRIN1HSD11B1 | |
| Hydrochloric Acid SCHEMBL1267297 | 0.79 | CTNNB1 (0.53) | KCNK3KCNK9HSD11B1RXFP1CYP11B1 | |
| Hydrochloric Acid SCHEMBL4379608 | 0.79 | CTNNB1 (0.53) | KCNK3KCNK9HSD11B1RXFP1CYP11B1 | |
| SCHEMBL102459 | 0.78 | GAA (0.42) | KCNK3KCNK9GRIN2BGRIN1HSD11B1 | |
| Hydrochloric Acid SCHEMBL23497846 | 0.78 | KCNK3 (0.40) | KCNK3KCNK9GRIN2BGRIN1HSD11B1 | |
| SCHEMBL102458 | 0.78 | GAA (0.42) | KCNK3KCNK9GRIN2BGRIN1HSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | claimed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | claimed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | claimed |