Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP12 | P39900 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9242922 | 1.00 | KCNH2 (0.36) | KCNH2FFAR1SLC6A3CYP1A2CHRM1 | |
| SCHEMBL9241292 | 0.96 | KCNH2 (0.39) | KCNH2FFAR1SLC6A3CHRM1HTR2A | |
| SCHEMBL9241301 | 0.96 | KCNH2 (0.39) | KCNH2FFAR1SLC6A3CHRM1HTR2A | |
| SCHEMBL9498804 | 0.96 | KCNH2 (0.39) | KCNH2FFAR1SLC6A3CYP1A2MMP2 | |
| SCHEMBL9498796 | 0.96 | KCNH2 (0.39) | KCNH2FFAR1SLC6A3CYP1A2MMP2 | |
| SCHEMBL9499025 | 0.92 | KCNH2 (0.41) | KCNH2FFAR1SLC6A3CYP1A2MMP2 | |
| SCHEMBL9499027 | 0.92 | KCNH2 (0.41) | KCNH2FFAR1SLC6A3CYP1A2MMP2 | |
| SCHEMBL9246648 | 0.92 | FFAR1 (0.38) | KCNH2FFAR1SLC6A3CHRM1HTR2A | |
| SCHEMBL9246645 | 0.92 | FFAR1 (0.38) | KCNH2FFAR1SLC6A3CHRM1HTR2A | |
| SCHEMBL9498057 | 0.90 | KCNH2 (0.43) | KCNH2FFAR1SLC6A3MMP2MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5447657-A | Liquid crystal compounds | HOFFMANN-LA ROCHE INC. (US) | 1995-09-05 | — | — | US | disclosed |