Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | BTK | Q06187 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6012435 | 0.88 | SIGMAR1 (0.53) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL6012414 | 0.84 | SIGMAR1 (0.44) | MEN1ALDH1A1KMT2ASIGMAR1SLC6A2 | |
| SCHEMBL1077100 | 0.82 | SIGMAR1 (0.51) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL21538553 | 0.81 | MEN1 (0.50) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL6012387 | 0.80 | TSHR (0.42) | LTA4HTSHRMEN1ALDH1A1KMT2A | |
| SCHEMBL6012315 | 0.80 | MEN1 (0.37) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL323955 | 0.79 | SIGMAR1 (0.56) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL1556809 | 0.78 | CYP2D6 (0.50) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL322962 | 0.78 | SIGMAR1 (0.54) | TSHRMEN1ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL7647406 | 0.76 | SIGMAR1 (0.71) | LTA4HTSHRMEN1ALDH1A1CYP2C9 |
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-7119091-B2 | Triazaspiro[5.5]undecane derivatives and pharmaceutical compositions comprising thereof, as an active ingredient | ONO PHARMACEUTICAL CO., LTD. (JP) | 2006-10-10 | — | — | US | disclosed |