Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.34 |
| ▸ | NOS3 | P29474 | 2/20 | 0.33 |
| ▸ | NOS2 | P35228 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | EPHA4 | P54764 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL23770633 | 0.90 | PLA2G7 (0.36) | BACE1DPP4NUDT1HSP90AA1EPHA4 | |
| SCHEMBL23770676 | 0.89 | ADORA2A (0.35) | ADORA2ACTSDBACE1DPP4NUDT1 | |
| SCHEMBL23770590 | 0.89 | ADORA2A (0.35) | ADORA2ACTSDBACE1DPP4NOS3 | |
| SCHEMBL23770595 | 0.89 | ADORA2A (0.35) | ADORA2ACTSDBACE1DPP4NOS3 | |
| SCHEMBL23770584 | 0.86 | GABRA1 (0.34) | ADORA2ACTSDBACE1DPP4EPHA4 | |
| SCHEMBL23770551 | 0.86 | PTPN1 (0.36) | ADORA2ACTSDBACE1DPP4EPHA4 | |
| SCHEMBL23770411 | 0.81 | NOS3 (0.33) | NOS3NOS2ALDH1A1MAPK1 | |
| SCHEMBL23770571 | 0.81 | NOS3 (0.33) | NOS3NOS2 | |
| SCHEMBL23770602 | 0.81 | NOS3 (0.33) | NOS3NOS2 | |
| SCHEMBL23770550 | 0.79 | NOS3 (0.31) | NOS3NOS2 |
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-3504194-B1 | N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE | NOVARTIS AG (CH) | 2021-08-18 | — | — | EP | disclosed |