Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.57 |
| ▸ | PDE5A | O76074 | 2/20 | 0.54 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.54 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.54 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.54 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7498013 | 0.81 | PDE5A (0.67) | EGFRPDE5ATBXAS1PDE3BPDE3A | |
| SCHEMBL2590386 | 0.77 | EGFR (0.70) | EGFRPDE5ATBXAS1PDE3BPDE3A | |
| SCHEMBL21055800 | 0.75 | EGFR (0.67) | EGFRPDE5ATBXAS1PDE3BPDE3A | |
| SCHEMBL7499766 | 0.74 | ALDH1A1 (0.51) | EGFRPDE5AERBB2ALDH1A1LMNA | |
| SCHEMBL6471210 | 0.73 | EGFR (0.50) | EGFRERBB2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3118629 | 0.73 | APP (0.68) | EGFRALDH1A1LMNAUSP2CYP1A2 | |
| SCHEMBL7260498 | 0.73 | CNR1 (0.54) | PDE5ACNR1 | |
| SCHEMBL7505003 | 0.72 | EGFR (0.71) | EGFRPDE5AALDH1A1LMNAUSP2 | |
| SCHEMBL3118894 | 0.72 | APP (0.74) | EGFRALDH1A1LMNAUSP2CYP1A2 | |
| SCHEMBL3847323 | 0.71 | EGFR (0.49) | EGFRPDE5ATBXAS1PDE3BPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| US-5801180-A | ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS | EISAI CO., LTD. (JP) | 1998-09-01 | — | — | US | disclosed |