Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.44 |
| ▸ | TP53 | P04637 | 5/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 11/20 | 0.38 |
| ▸ | NPC1 | O15118 | 7/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 6/20 | 0.38 |
| ▸ | GPX4 | P36969 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 5/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.30 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11702860 | 0.91 | ALDH1A1 (0.50) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11702004 | 0.84 | TP53 (0.52) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11873283 | 0.82 | TP53 (0.49) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11698785 | 0.79 | ALDH1A1 (0.39) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11872117 | 0.76 | ALDH1A1 (0.59) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL11698654 | 0.76 | TP53 (0.64) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11877212 | 0.76 | TDP1 (0.54) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11702785 | 0.76 | ALDH1A1 (0.34) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11870465 | 0.75 | TDP1 (0.53) | ALDH1A1TP53TDP1NR1I2CYP3A4 | |
| SCHEMBL11264198 | 0.75 | TP53 (0.67) | ALDH1A1TP53TDP1NR1I2CYP3A4 |
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-4046554-A | HERBICIDES | VELSICOL CHEMICAL CORPORATION (US) | 1977-09-06 | — | — | US | disclosed |
| US-3966811-A | HERBICIDES | VELSICOL CHEMICAL CORPORATION (US) | 1976-06-29 | — | — | US | disclosed |