Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | NEK2 | P51955 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3784069 | 0.87 | ALDH1A1 (0.43) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| SCHEMBL3790652 | 0.86 | ALDH1A1 (0.48) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| SCHEMBL3786195 | 0.83 | PGR (0.43) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| SCHEMBL11811790 | 0.82 | CYP3A4 (0.46) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| SCHEMBL3786869 | 0.82 | MAOA (0.45) | ALDH1A1CYP3A4KMT2AMAPTCASP1 | |
| SCHEMBL21629684 | 0.82 | ALDH1A1 (0.54) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| Hydrochloric Acid SCHEMBL6572274 | 0.82 | PGR (0.42) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| SCHEMBL1932071 | 0.80 | USP7 (0.43) | ALDH1A1CYP3A4MAPK1TP53ALOX15 | |
| SCHEMBL7406313 | 0.80 | GAA (0.59) | ALDH1A1CYP3A4MAPK1TP53TDP1 | |
| SCHEMBL214484 | 0.78 | ALDH1A1 (0.54) | ALDH1A1CYP3A4MAPK1TP53TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4520093-A | COMPENSATING PIGMENTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-05-28 | — | — | US | disclosed |
| US-4211561-A | SILVER HALIDE EMULSIONS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-07-08 | — | — | US | disclosed |