Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 1/20 | 0.51 |
| ▸ | PSEN1 | P49768 | 4/20 | 0.48 |
| ▸ | PSEN2 | P49810 | 4/20 | 0.48 |
| ▸ | APH1B | Q8WW43 | 4/20 | 0.48 |
| ▸ | NCSTN | Q92542 | 4/20 | 0.48 |
| ▸ | APH1A | Q96BI3 | 4/20 | 0.48 |
| ▸ | PSENEN | Q9NZ42 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CTSV | O60911 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | CTSC | P53634 | 1/20 | 0.40 |
| ▸ | CTSF | Q9UBX1 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21806790 | 1.00 | KCNA5 (0.51) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL21806792 | 1.00 | KCNA5 (0.51) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL22527528 | 0.94 | AR (0.44) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL22527530 | 0.94 | AR (0.44) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL22527529 | 0.94 | AR (0.44) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL21359781 | 0.83 | PSEN1 (0.53) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL16194688 | 0.81 | KCNA5 (0.43) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL16194687 | 0.81 | KCNA5 (0.43) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL24898571 | 0.81 | PSEN1 (0.41) | KCNA5PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL22664652 | 0.81 | PSEN1 (0.41) | KCNA5PSEN1PSEN2APH1BNCSTN |
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-3853230-A1 | CDPK1 INHIBITORS, COMPOSITIONS, AND METHODS RELATED THERETO | Vyera Pharmaceuticals, LLC (US) | 2021-07-28 | — | — | EP | disclosed |
| WO-2020061279-A1 | CDPK1 INHIBITORS, COMPOSITIONS, AND METHODS RELATED THERETO | Vyera Pharmaceuticals, LLC (US) | 2020-03-26 | — | — | WO | disclosed |