Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | TYR | P14679 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.48 |
| ▸ | HPN | P05981 | 1/20 | 0.48 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | MIF | P14174 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4982793 | 0.98 | CYP2C9 (0.68) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL39962 | 0.83 | CA2 (0.70) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| Methane SCHEMBL11570553 | 0.80 | CA2 (0.67) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| Methyl Alcohol SCHEMBL27833029 | 0.80 | CA2 (0.67) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL12620456 | 0.79 | CYP2C19 (0.47) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL38838 | 0.79 | SMN1; SMN2 (0.77) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL5318298 | 0.79 | SMN1; SMN2 (0.77) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL11525980 | 0.79 | ALDH1A1 (0.46) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL2343165 | 0.79 | CYP2C9 (1.00) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL20132974 | 0.79 | ALDH1A1 (0.46) | CYP2C9CYP2C19CYP1A2SMN1; SMN2ALDH1A1 |
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-4303759-A | REACTIVE SULFUR COMPOUND DECOMPOSES PEROXYL RADICAL | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1981-12-01 | — | — | US | claimed |