Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 11/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL6615035 | 1.00 | SLC6A4 (0.38) | SLC6A4SLC6A3SLC6A2CYP2D6HTR2C | |
| SCHEMBL19237328 | 0.69 | SLC6A2 (0.55) | SLC6A4SLC6A3SLC6A2CYP2D6CYP1A2 | |
| SCHEMBL10043019 | 0.69 | SLC6A2 (0.55) | SLC6A4SLC6A3SLC6A2CYP2D6CYP1A2 | |
| SCHEMBL16406341 | 0.69 | SLC6A2 (0.35) | SLC6A4SLC6A3SLC6A2CYP2D6HTR2C | |
| SCHEMBL16406337 | 0.69 | HTR2A (0.39) | SLC6A4SLC6A3SLC6A2CYP2D6HTR2C | |
| SCHEMBL10279685 | 0.68 | SLC6A2 (0.46) | SLC6A4SLC6A3SLC6A2CYP2D6CYP1A2 | |
| SCHEMBL16884630 | 0.66 | SLC6A2 (0.47) | SLC6A4SLC6A3SLC6A2CYP2D6HTR2C | |
| SCHEMBL13959656 | 0.66 | DRD2 (0.52) | SLC6A4SLC6A3SLC6A2CYP2D6HTR2C | |
| SCHEMBL655089 | 0.66 | GRIN1 (0.42) | SLC6A4SLC6A2HTR2CHTR2AHTR2B | |
| SCHEMBL9921757 | 0.63 | SLC6A3 (0.49) | SLC6A4SLC6A3SLC6A2HTR2CHTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1467986-A1 | AZA-CYCLIC COMPOUNDS AS MODULATORS OF ACETYLCHOLINE RECEPTORS | ELI LILLY AND COMPANY (US) | 2004-10-20 | — | — | EP | disclosed |
| WO-2003062224-A1 | AZA-CYCLIC COMPOUNDS AS MODULATORS OF ACETYLCHOLINE RECEPTORS | ELI LILLY AND COMPANY (US) | 2003-07-31 | — | — | WO | disclosed |