Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | NOS1 | P29475 | 4/20 | 0.36 |
| ▸ | NOS2 | P35228 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NOS3 | P29474 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | CFD | P00746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27819285 | 0.84 | ABAT (0.39) | LOXL2CES2CES1ALDH1A1CYP3A4 | |
| SCHEMBL39274 | 0.77 | CES2 (0.55) | CES2CES1ALDH1A1PTGS2ESR1 | |
| SCHEMBL27819250 | 0.73 | HDAC1 (0.47) | CES2CES1ALDH1A1SMN1; SMN2PTGS2 | |
| SCHEMBL8412560 | 0.71 | CES2 (0.57) | CES2CES1PTGS2ESR1 | |
| SCHEMBL3734266 | 0.71 | HSD17B3 (0.56) | ALDH1A1SMN1; SMN2CYP3A4PTGS2ESR1 | |
| SCHEMBL27652384 | 0.70 | LOXL2 (0.61) | LOXL2ENPP2NOS1NOS2ALDH1A1 | |
| SCHEMBL28027049 | 0.70 | CES2 (0.36) | CES2CES1ALDH1A1CYP3A4PNMT | |
| Hydrochloric Acid SCHEMBL13570501 | 0.69 | LOXL2 (0.57) | LOXL2ENPP2CES2CES1NOS1 | |
| SCHEMBL18736490 | 0.69 | SMN1; SMN2 (0.57) | LOXL2ALDH1A1SMN1; SMN2CFD | |
| SCHEMBL27798187 | 0.68 | HDAC3 (0.41) | CES2CES1ALDH1A1ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104910051-A | Nitrone-substituted sulfonylarylamine derivative and preparation method thereof | UNIV ZHENGZHOU | 2015-09-16 | — | — | CN | disclosed |