Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | KIF11 | P52732 | 11/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPY2R | P49146 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL8365385 | 0.89 | SIGMAR1 (0.50) | SIGMAR1KIF11KCNH2CYP2D6CYP2C9 | |
| SCHEMBL532850 | 0.78 | KIF11 (0.61) | KIF11KCNH2CYP2D6CYP2C9CYP2C19 | |
| Diethylaniline SCHEMBL6747844 | 0.76 | KIF11 (0.44) | SIGMAR1KIF11KCNH2CYP2D6CYP2C9 | |
| SCHEMBL15051981 | 0.76 | KIF11 (0.59) | KIF11KCNH2CYP2D6CYP2C9CYP2C19 | |
| Water SCHEMBL28757871 | 0.76 | KIF11 (0.59) | KIF11KCNH2CYP2D6CYP2C9CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL4606388 | 0.76 | KIF11 (0.59) | KIF11KCNH2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL810137 | 0.70 | KIF11 (0.57) | SIGMAR1KIF11KCNH2CYP2D6CYP2C9 | |
| Tetrabuthylammonium SCHEMBL22518565 | 0.70 | KIF11 (0.44) | KIF11KCNH2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1974299 | 0.66 | KIF11 (0.61) | SIGMAR1KIF11KCNH2CYP2D6CYP2C9 | |
| SCHEMBL7092683 | 0.66 | KIF11 (0.54) | KIF11KCNH2CYP2D6CYP2C9CYP2C19 |
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-5998496-A | ABSORBING RADIATION | SPECTRA GROUP LIMITED, INC. (US) | 1999-12-07 | — | — | US | disclosed |