Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 18/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4307636 | 1.00 | SLC6A4 (0.42) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL28322331 | 0.90 | SLC6A2 (0.36) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL31250397 | 0.85 | SLC6A4 (0.38) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL28517055 | 0.84 | SLC6A4 (0.35) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL28616203 | 0.81 | SLC6A4 (0.36) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL743575 | 0.81 | SLC6A4 (0.37) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL476847 | 0.81 | SLC6A4 (0.37) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL1290220 | 0.81 | SLC6A4 (0.37) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL28517032 | 0.80 | SLC6A4 (0.33) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL27479621 | 0.80 | SMN1; SMN2 (0.30) | — |
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-2009137492-A1 | HETEROARYL-FUSED MACROCYCLIC PYRIMIDINE DERIVATIVES | ABBOTT LABORATORIES (US) | 2009-11-12 | — | — | WO | disclosed |