Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.69 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.69 |
| ▸ | MEN1 | O00255 | 1/20 | 0.69 |
| ▸ | USP2 | O75604 | 1/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
| ▸ | HPGD | P15428 | 1/20 | 0.69 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.69 |
| ▸ | CES1 | P23141 | 2/20 | 0.66 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.52 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL5716919 | 0.90 | CES1 (0.79) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL29460197 | 0.89 | CES1 (0.83) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL893374 | 0.81 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL30702421 | 0.81 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL380656 | 0.79 | CES1 (1.00) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL22609991 | 0.75 | CES1 (0.81) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| Chrysene SCHEMBL4826189 | 0.73 | HPRT1 (0.70) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL6851988 | 0.73 | ALDH1A1 (0.62) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| Chrysene SCHEMBL384031 | 0.72 | HPRT1 (1.00) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A | |
| Chrysene SCHEMBL27115 | 0.72 | HPRT1 (1.00) | ALDH1A1CYP1A2CYP2C9CYP2C19HIF1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021158575-A1 | COMPOSITIONS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES | Natural Extraction Systems, LLC (US) | 2021-08-12 | — | — | WO | claimed |
| WO-2021158573-A1 | METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES | Natural Extraction Systems, LLC (US) | 2021-08-12 | — | — | WO | claimed |
| WO-2021042001-A1 | COMPOSITIONS AND METHODS RELATED TO DISSOLVED OXIDES | Natural Extraction Systems, LLC (US) | 2021-03-04 | — | — | WO | claimed |
| WO-2021158573-A1 | METHODS RELATED TO BIOACTIVE AGENTS THAT CONVERT FROM ANIONS TO MOLECULES | Natural Extraction Systems, LLC (US) | 2021-08-12 | — | — | WO | disclosed |
| WO-2021042001-A1 | COMPOSITIONS AND METHODS RELATED TO DISSOLVED OXIDES | Natural Extraction Systems, LLC (US) | 2021-03-04 | — | — | WO | disclosed |