Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | TACR2 | P21452 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | KMT5B | Q4FZB7 | 1/20 | 0.38 |
| ▸ | KMT5C | Q86Y97 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4837981 | 0.86 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL8551380 | 0.81 | LMNA (0.45) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL1268020 | 0.80 | ESR1 (0.49) | ADORA2AALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL4840257 | 0.77 | MAPK14 (0.46) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL8548298 | 0.77 | PLAU (0.40) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL7914983 | 0.75 | NPSR1 (0.53) | ALDH1A1MEN1KMT2ANPSR1SMN1; SMN2 | |
| SCHEMBL8548292 | 0.74 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL9139946 | 0.73 | SMN1; SMN2 (0.41) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL30170698 | 0.73 | AHR (0.41) | ALDH1A1MEN1KMT2ATP53TSHR | |
| SCHEMBL6591372 | 0.73 | AHR (0.41) | ALDH1A1MEN1KMT2ATP53TSHR |
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 |