Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 6/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | RGS12 | O14924 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9708605 | 0.92 | ADORA2B (0.42) | AGTR1AGTR2ADORA3ADORA2B | |
| SCHEMBL9708298 | 0.90 | ADORA2B (0.40) | KDM4EHPGDAGTR1AGTR2MEN1 | |
| SCHEMBL9708519 | 0.90 | DCTPP1 (0.42) | KDM4EHPGDAGTR1AGTR2MEN1 | |
| SCHEMBL9707975 | 0.90 | AGTR1 (0.42) | AGTR1AGTR2ADORA2B | |
| SCHEMBL9707747 | 0.89 | KDM4E (0.44) | KDM4EHPGDAGTR1AGTR2ADORA2B | |
| SCHEMBL9707424 | 0.89 | AGTR1 (0.44) | AGTR1AGTR2 | |
| SCHEMBL9708226 | 0.89 | AGTR1 (0.38) | AGTR1AGTR2MAPTMCOLN3ADORA3 | |
| SCHEMBL9708252 | 0.88 | ADORA3 (0.42) | KDM4EHPGDAGTR1AGTR2ADORA3 | |
| SCHEMBL9707499 | 0.88 | MEN1 (0.39) | AGTR1AGTR2MEN1KMT2AADORA2B | |
| SCHEMBL9707884 | 0.88 | AGTR1 (0.49) | AGTR1AGTR2 |
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 |