Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | NPY2R | P49146 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | AADAT | Q8N5Z0 | 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 | |
|---|---|---|---|---|
| SCHEMBL18938223 | 0.84 | MT-CO2 (0.32) | ACHE | |
| SCHEMBL18754564 | 0.74 | ACHE (0.46) | TSHRACHEKMT2AAADAT | |
| SCHEMBL17356841 | 0.72 | ALDH1A1 (0.43) | TSHRACHEALDH1A1MAPTHPGD | |
| SCHEMBL17425982 | 0.68 | RAB9A (0.46) | TSHRMEN1KMT2ARAB9A | |
| SCHEMBL17425986 | 0.68 | TSHR (0.54) | TSHRALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL17432743 | 0.67 | MEN1 (0.53) | TSHRACHEALDH1A1HPGDMEN1 | |
| SCHEMBL3884759 | 0.67 | ALDH1A1 (0.67) | TSHRACHEALDH1A1MAPTHPGD | |
| SCHEMBL17425973 | 0.64 | ALDH1A1 (0.47) | ALDH1A1HSD17B10MEN1CASP1CASP7 | |
| SCHEMBL5094308 | 0.62 | RAB9A (0.44) | TSHRALDH1A1KMT2AADORA2ARAB9A | |
| SCHEMBL19702964 | 0.61 | CYP2C19 (0.40) | TSHRALDH1A1MAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2965809-B1 | OXYGEN ABSORBER COMPOSITION, AND MOLDED BODY AND PACKAGE EACH USING SAME | MITSUBISHI GAS CHEMICAL CO (JP) | 2017-06-07 | — | — | EP | disclosed |