Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.39 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL178138 | 0.86 | — | — | |
| Water SCHEMBL8421441 | 0.84 | ALDH1A1 (0.52) | ALDH1A1MAPTCA12CA2CA9 | |
| Hydrochloric Acid SCHEMBL10887315 | 0.84 | ALDH1A1 (0.52) | ALDH1A1MAPTCA12CA2CA9 | |
| SCHEMBL4640291 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTCA12CA2CA9 | |
| SCHEMBL9840384 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTCA12CA2CA9 | |
| Sulfuric Acid SCHEMBL10976515 | 0.80 | CA2 (0.50) | ALDH1A1MAPTCA12CA2CA9 | |
| Diphenylamine SCHEMBL1961990 | 0.74 | HSD17B10 (0.67) | ALDH1A1MAPTTSHRGAALMNA | |
| SCHEMBL4946799 | 0.71 | ERCC1 (0.47) | ALDH1A1MAPTCA12CA2ERCC1 | |
| SCHEMBL1330698 | 0.70 | ABAT (0.53) | ALDH1A1MAPTERCC1ERCC4TP53 | |
| SCHEMBL302557 | 0.70 | ALDH1A1 (0.48) | ALDH1A1MAPTCA12CA2CA9 |
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-107099016-A | Trigger response chain fragmentation polymer | 伊利诺伊大学董事会 | 2017-08-29 | — | — | CN | disclosed |