Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.37 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL24826099 | 0.83 | KCNN4 (0.42) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL8583526 | 0.83 | KCNN4 (0.42) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL17267041 | 0.83 | KCNN4 (0.42) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL30014426 | 0.82 | PDK1 (0.40) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL18674881 | 0.81 | KCNN4 (0.41) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL20076543 | 0.80 | ACHE (0.42) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL11415516 | 0.80 | ACHE (0.42) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL7777113 | 0.80 | KCNN4 (0.44) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL17080367 | 0.79 | KCNN4 (0.40) | PDK1PDK2PDK3PDK4KCNN4 | |
| SCHEMBL8716679 | 0.79 | KCNN4 (0.44) | PDK1PDK2PDK3PDK4KCNN4 |
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-1335907-A1 | PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR | BIOVITRUM AB (SE) | 2003-08-20 | — | — | EP | disclosed |
| WO-2002040456-A1 | PIPERAZINYLPYRAZINE COMPOUNDS AS AGONIST OR ANTAGONIST OF SEROTONIN 5HT-2 RECEPTOR | BIOVITRUM AB (SE) | 2002-05-23 | — | — | WO | disclosed |