Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | TACR2 | P21452 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | KMT5B | Q4FZB7 | 1/20 | 0.34 |
| ▸ | KMT5C | Q86Y97 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8547080 | 0.82 | KDR (0.43) | ADORA2AADORA1ADORA3GABRA1TACR2 | |
| SCHEMBL8552965 | 0.75 | PLAU (0.44) | ADORA2AADORA1ADORA3NPSR1RXFP1 | |
| SCHEMBL8552255 | 0.75 | ADORA2A (0.44) | ADORA2AADORA1NPC1MAPTRAB9A | |
| SCHEMBL8548292 | 0.74 | ADORA2A (0.41) | ADORA2AADORA1ADORA3GABRA1TACR2 | |
| SCHEMBL8553138 | 0.71 | POLB (0.37) | NPC1MAPTRAB9ANPSR1RXFP1 | |
| SCHEMBL8551930 | 0.65 | NPSR1 (0.51) | MAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL8550943 | 0.64 | NPSR1 (0.50) | MAPTNPSR1 | |
| SCHEMBL9807627 | 0.64 | METAP1 (0.47) | ADORA2AADORA1NPC1MAPTRAB9A | |
| Hydrochloric Acid SCHEMBL8548606 | 0.63 | ALDH1A1 (0.42) | MAPTNPSR1 | |
| SCHEMBL8549645 | 0.62 | LRRK2 (0.53) | NPC1RAB9ANPSR1CCR1CCR5 |
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-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |