Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.41 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.37 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | KAT6A | Q92794 | 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 | |
|---|---|---|---|---|
| SCHEMBL10602905 | 0.85 | KCNN4 (0.42) | KCNN4KCNE1KCNQ1CES2CES1 | |
| SCHEMBL30014426 | 0.82 | PDK1 (0.40) | KCNN4KCNE1KCNQ1PDK2PDK1 | |
| SCHEMBL10686262 | 0.80 | KCNN4 (0.39) | KCNN4KCNE1KCNQ1CES2CES1 | |
| SCHEMBL7777113 | 0.80 | KCNN4 (0.44) | KCNN4KCNE1KCNQ1CES2CES1 | |
| SCHEMBL6489440 | 0.78 | KCNN4 (0.42) | KCNN4KCNE1KCNQ1CES2CES1 | |
| SCHEMBL24901411 | 0.76 | MEN1 (0.46) | KCNN4KCNE1KCNQ1PDK2PDK1 | |
| SCHEMBL13615442 | 0.76 | KCNN4 (0.37) | KCNN4KCNE1KCNQ1PDK2PDK1 | |
| SCHEMBL12764916 | 0.76 | ACHE (0.39) | KCNN4KCNE1KCNQ1PDK2PDK1 | |
| SCHEMBL7206142 | 0.76 | PDK1 (0.42) | KCNN4KCNE1KCNQ1CES2CES1 | |
| SCHEMBL2974843 | 0.75 | KCNN4 (0.44) | KCNN4KCNE1KCNQ1CES2CES1 |
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-2007136570-A2 | 5,6-FUSED PYRROLIDINE COMPOUNDS USEFUL AS TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2007-11-29 | — | — | WO | claimed |
| CN-112500517-A | Oil-soluble super-heavy oil viscosity reducer and preparation method and application thereof | 山东德仕化工有限公司 | 2021-03-16 | — | — | CN | disclosed |
| WO-2007136570-A2 | 5,6-FUSED PYRROLIDINE COMPOUNDS USEFUL AS TACHYKININ RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2007-11-29 | — | — | WO | disclosed |