Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.30 |
| ▸ | CHRNG | P07510 | 1/20 | 0.30 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.30 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | CHRND | Q07001 | 1/20 | 0.30 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17548042 | 0.85 | HSD11B1 (0.33) | HSD11B1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13408478 | 0.84 | SLC6A2 (0.38) | SLC6A2SLC6A4SLC6A3CHRNA1CHRNG | |
| SCHEMBL17548044 | 0.84 | BACE1 (0.34) | HSD11B1SLC6A2SLC6A4SLC6A3CHRNA1 | |
| SCHEMBL13785220 | 0.83 | — | — | |
| SCHEMBL21654545 | 0.80 | PKM (0.33) | — | |
| SCHEMBL12718830 | 0.79 | — | — | |
| SCHEMBL13408479 | 0.77 | SLC6A2 (0.35) | HSD11B1SLC6A2SLC6A4SLC6A3CHRNA1 | |
| SCHEMBL10027429 | 0.74 | — | — | |
| SCHEMBL10014152 | 0.73 | HTR2A (0.33) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10432573 | 0.73 | HTR2A (0.33) | SLC6A2SLC6A4SLC6A3 |
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-2023232753-A1 | FERROELECTRIC SMECTIC LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2023-12-07 | — | — | WO | disclosed |