Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | THRB | P10828 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | CA1 | P00915 | 5/20 | 0.59 |
| ▸ | CA2 | P00918 | 5/20 | 0.59 |
| ▸ | CES2 | O00748 | 1/20 | 0.59 |
| ▸ | CES1 | P23141 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | BCL9 | O00512 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1097455 | 0.89 | ALDH1A1 (0.64) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL5164301 | 0.85 | CA1 (0.66) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL8837359 | 0.84 | ALDH1A1 (0.79) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL6049724 | 0.83 | CA1 (0.62) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL972717 | 0.82 | CA1 (0.67) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL851431 | 0.82 | CA1 (0.67) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL16859705 | 0.81 | ALDH1A1 (0.70) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL18730273 | 0.81 | CA1 (0.65) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL3930562 | 0.81 | ALDH1A1 (0.69) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA | |
| SCHEMBL955844 | 0.81 | CA1 (0.70) | ALDH1A1HSD17B10CYP3A4MAPK1LMNA |
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-5677432-A | FORMING IMMUNOCONJUGATES FOR DETECTION OF ORGANOPHOSPHATE PESTICIDES | THE HORTICULTURE AND FOOD RESEARCH INSTITUTE OF NEW ZEALAND LIMITED (NZ) | 1997-10-14 | — | — | US | disclosed |