Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 6/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL153943 | 0.78 | TSHR (0.67) | TSHRALDH1A1MAPTAPPRECQL | |
| SCHEMBL9781529 | 0.78 | MAPT (0.46) | ALDH1A1MAPTCA2CA1CYP3A4 | |
| SCHEMBL21480319 | 0.76 | MAPT (0.46) | TSHRALDH1A1MAPTAPPHSD17B10 | |
| SCHEMBL24000521 | 0.76 | TSHR (0.43) | TSHRALDH1A1MAPTAPPRECQL | |
| SCHEMBL13839266 | 0.76 | ALDH1A1 (0.44) | TSHRALDH1A1MAPTAPPRECQL | |
| Hydrochloric Acid SCHEMBL6241253 | 0.75 | TSHR (0.62) | TSHRALDH1A1MAPTAPPRECQL | |
| Bromide SCHEMBL7630752 | 0.75 | TSHR (0.62) | TSHRALDH1A1MAPTAPPRECQL | |
| Hydrochloric Acid SCHEMBL2801770 | 0.75 | TSHR (0.62) | TSHRALDH1A1MAPTAPPRECQL | |
| SCHEMBL4154037 | 0.74 | ALDH1A1 (0.54) | TSHRALDH1A1MAPTAPPRECQL | |
| Hydrochloric Acid SCHEMBL29396324 | 0.72 | TSHR (0.46) | TSHRALDH1A1MAPTHSD17B10TP53 |
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-3053875-B1 | FLUORINATING AGENT | DAIKIN IND LTD (JP) | 2022-09-28 | — | — | EP | disclosed |