Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 15/20 | 0.42 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15971696 | 0.82 | OPRK1 (0.45) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL17387847 | 0.82 | OPRK1 (0.45) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22031993 | 0.81 | OPRK1 (0.49) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL25065698 | 0.81 | OPRK1 (0.49) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22031992 | 0.81 | OPRK1 (0.49) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22996455 | 0.75 | CNR2 (0.50) | OPRK1AR | |
| SCHEMBL23754091 | 0.74 | CHRNB2 (0.41) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL20474638 | 0.74 | OPRK1 (0.42) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL29906538 | 0.74 | CHRNB2 (0.41) | OPRK1JAK2CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL19343217 | 0.74 | CNR2 (0.52) | OPRK1AR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3585776-B1 | 5-(PYRIMIDIN-4-YL)-2-(PYRROLIDIN-1-YL)NICOTINONITRILE COMPOUNDS AS IKKE, TBK1 AND/OR SIK2 KINASES INHIBITORS | DOMAINEX LTD (GB) | 2021-02-17 | — | — | EP | disclosed |