Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 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 | |
|---|---|---|---|---|
| SCHEMBL22120124 | 1.00 | NPC1 (0.40) | NPC1MAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL29460881 | 0.87 | DRD2 (0.41) | HTR1AOPRK1 | |
| SCHEMBL1016712 | 0.87 | DRD2 (0.41) | HTR1AOPRK1 | |
| SCHEMBL31161182 | 0.79 | NOTUM (0.34) | — | |
| SCHEMBL15956758 | 0.79 | NOTUM (0.34) | — | |
| SCHEMBL17645720 | 0.78 | JAK2 (0.32) | JAK2BTK | |
| SCHEMBL20595135 | 0.77 | KDM1A (0.33) | — | |
| SCHEMBL18342173 | 0.77 | P2RX7 (0.35) | HTR1AJAK2BTK | |
| SCHEMBL31707905 | 0.76 | ALDH1A1 (0.37) | JAK2BTK | |
| SCHEMBL508291 | 0.76 | ALDH1A1 (0.37) | JAK2BTK |
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-4090660-A1 | QUINOXALINE DERIVATIVES | Grünenthal GmbH (DE) | 2022-11-23 | — | — | EP | disclosed |