Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9708111 | 0.94 | ALDH1A1 (0.39) | ALDH1A1POLBSMN1; SMN2AGTR1AGTR2 | |
| SCHEMBL9708661 | 0.94 | AGTR1 (0.38) | AGTR1AGTR2 | |
| SCHEMBL9707503 | 0.91 | ADORA3 (0.38) | — | |
| SCHEMBL9708665 | 0.91 | AGTR1 (0.38) | AGTR1AGTR2 | |
| SCHEMBL9707596 | 0.91 | AGTR1 (0.36) | AGTR1AGTR2 | |
| SCHEMBL9707857 | 0.91 | ALDH1A1 (0.38) | ALDH1A1POLBSMN1; SMN2DPP4BRAF | |
| SCHEMBL9708253 | 0.90 | PDE5A (0.36) | AGTR1AGTR2 | |
| SCHEMBL9708349 | 0.90 | AGTR1 (0.41) | ALDH1A1POLBSMN1; SMN2AGTR1AGTR2 | |
| SCHEMBL9708639 | 0.90 | AGTR1 (0.35) | ALDH1A1AGTR1AGTR2KMT2A | |
| SCHEMBL9708613 | 0.89 | DPP4 (0.39) | DPP4BRAFPIK3CGMAPTRAB9A |
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 |