Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 7/20 | 0.42 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9708598 | 0.97 | ADORA1 (0.44) | AGTR1AGTR2ADORA1HSD17B10ADORA3 | |
| SCHEMBL9707297 | 0.97 | ADORA3 (0.43) | AGTR1AGTR2ADORA1ADORA3 | |
| SCHEMBL9707529 | 0.97 | ADORA3 (0.43) | AGTR1AGTR2ADORA1ADORA3 | |
| SCHEMBL9707495 | 0.96 | ADORA1 (0.45) | AGTR1AGTR2ADORA1HSD17B10ADORA3 | |
| SCHEMBL9708387 | 0.95 | POLB (0.44) | AGTR1POLBHIF1AALOX15ALDH1A1 | |
| SCHEMBL9707632 | 0.95 | ALOX15 (0.43) | AGTR1AGTR2ALOX15ALDH1A1HSD17B10 | |
| SCHEMBL9708824 | 0.95 | ADORA3 (0.41) | AGTR1AGTR2MEN1KMT2AALDH1A1 | |
| SCHEMBL9708259 | 0.95 | ADORA3 (0.41) | AGTR1AGTR2MEN1KMT2AALDH1A1 | |
| SCHEMBL9707973 | 0.94 | ADORA1 (0.42) | AGTR1AGTR2MEN1KMT2AADORA1 | |
| SCHEMBL9708814 | 0.93 | AGTR1 (0.39) | AGTR1AGTR2POLBHIF1AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992007852-A1 | BIPHENYLALKYL XANTHINE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1992-05-14 | — | — | WO | disclosed |