Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | SLC6A6 | P31641 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28632901 | 0.86 | SMN1; SMN2 (0.42) | CYP2C19 | |
| SCHEMBL28631116 | 0.85 | CYP2D6 (0.40) | LMNACYP2C19 | |
| SCHEMBL27944009 | 0.81 | APP (0.36) | APPLMNASLC6A6CYP2C19BLM | |
| SCHEMBL17830936 | 0.74 | APP (0.36) | APPLMNASLC6A6CYP2C19BLM | |
| SCHEMBL8980213 | 0.70 | APP (0.36) | APPLMNASLC6A6CYP2C19BLM | |
| SCHEMBL8038126 | 0.69 | APP (0.32) | APP | |
| SCHEMBL10430358 | 0.69 | APP (0.35) | APP | |
| SCHEMBL18155964 | 0.69 | APP (0.35) | APP | |
| Bromide SCHEMBL29283490 | 0.68 | NPC1 (0.35) | PTGS1LMNACYP2C19 | |
| SCHEMBL28633307 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113248441-A | Dual-functional ionic liquid, preparation method thereof and application thereof in catalytic synthesis of bisphenol compound | 大连理工大学 | 2021-08-13 | — | — | CN | disclosed |