Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.72 |
| ▸ | TSHR | P16473 | 3/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.71 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.71 |
| ▸ | TTR | P02766 | 1/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.71 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.71 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.71 |
| ▸ | PPARG | P37231 | 1/20 | 0.71 |
| ▸ | HTR2B | P41595 | 1/20 | 0.71 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.71 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.71 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.71 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18264902 | 0.88 | PPARA (0.73) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| SCHEMBL21391385 | 0.85 | PPARA (0.69) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| SCHEMBL8912551 | 0.84 | PPARA (0.75) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| SCHEMBL21413777 | 0.84 | NR1H4 (0.72) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| SCHEMBL10473599 | 0.84 | PPARA (0.67) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| Gemfibrozil SCHEMBL4813 | 0.83 | PPARA (1.00) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| Gemfibrozil SCHEMBL20770039 | 0.83 | PPARA (1.00) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| SCHEMBL9481043 | 0.83 | PPARA (0.79) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| Gemfibrozil SCHEMBL29398115 | 0.83 | PPARA (1.00) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 | |
| SCHEMBL12690944 | 0.83 | PPARA (0.79) | PPARATSHRCYP2C9CYP2C8SMN1; SMN2 |
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-9505732-B2 | Auto magnetic metal salen complex compound | IHI CORPORATION (JP) | 2016-11-29 | — | — | US | disclosed |