Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 3/20 | 0.31 |
| ▸ | HTR1D | P28221 | 3/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.31 |
| ▸ | DRD4 | P21917 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | HTR1B | P28222 | 1/20 | 0.31 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | CCKAR | P32238 | 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 | |
|---|---|---|---|---|
| SCHEMBL5549046 | 0.88 | KDM4E (0.35) | SLC6A7HTR1AHTR1DSLC6A4KCNH2 | |
| SCHEMBL4889339 | 0.85 | SLC6A7 (0.34) | SLC6A7HTR1AHTR1DSLC6A4KCNH2 | |
| SCHEMBL5387953 | 0.83 | NCF1 (0.38) | CYP1A2CYP2C19HTR1AHTR1DALDH1A1 | |
| SCHEMBL4163673 | 0.78 | ACHE (0.42) | ALDH1A1 | |
| SCHEMBL4558300 | 0.71 | SLC6A9 (0.44) | SLC6A7CYP1A2HTR1AHTR1DDRD4 | |
| SCHEMBL23536457 | 0.71 | GFER (0.34) | SLC6A7HTR1ADRD2DRD3 | |
| SCHEMBL23037387 | 0.71 | PBRM1 (0.41) | SLC6A7ALDH1A1 | |
| SCHEMBL7845835 | 0.70 | SLC6A7 (0.43) | SLC6A7HTR1ACXCR3DRD2DRD3 | |
| SCHEMBL429715 | 0.70 | MAPT (0.42) | SLC6A7HTR1AHTR1DSLC6A4KCNH2 | |
| SCHEMBL2327343 | 0.70 | RBP4 (0.37) | SLC6A7ALDH1A1DRD2NPC1 |
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-1853604-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2007-11-14 | — | — | EP | disclosed |
| WO-2006096444-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-09-14 | — | — | WO | disclosed |