Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 13/20 | 0.39 |
| ▸ | CTSS | P25774 | 10/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 3/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28776848 | 0.88 | CTSK (0.42) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL28391077 | 0.88 | CTSK (0.42) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL21946035 | 0.88 | CTSK (0.42) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL21946033 | 0.83 | KMT2A (0.38) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL7926354 | 0.83 | KMT2A (0.38) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL13763647 | 0.78 | CTSK (0.36) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL15195550 | 0.78 | CTSK (0.36) | CTSKCTSSKMT2AMEN1MAPK1 | |
| SCHEMBL5229523 | 0.78 | MEN1 (0.41) | KMT2AMEN1MAPK1ALDH1A1 | |
| SCHEMBL5934647 | 0.78 | MEN1 (0.41) | KMT2AMEN1MAPK1ALDH1A1 | |
| SCHEMBL14416213 | 0.78 | MEN1 (0.41) | KMT2AMEN1MAPK1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020083336-A1 | 1,3,4-OXADIAZOLE-2-CYCLOBUTYL COMPOUNDS, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 南京圣和药业股份有限公司 | 2020-04-30 | — | — | WO | disclosed |