Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.51 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL11790690 | 0.98 | KEAP1 (0.55) | KEAP1ALDH1A1ALOX15CYP19A1CYP1A1 | |
| SCHEMBL5176495 | 0.85 | CYP1A1 (0.60) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| Phthalic Acid SCHEMBL4430760 | 0.85 | ALDH1A1 (0.70) | KEAP1ALDH1A1ALOX15FFAR1MAPT | |
| Dihydrochalcone SCHEMBL2827303 | 0.82 | CYP19A1 (0.80) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| Dihydrochalcone SCHEMBL29359372 | 0.82 | CYP19A1 (0.80) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| Dihydrochalcone SCHEMBL7540273 | 0.81 | CYP19A1 (0.77) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| SCHEMBL27540915 | 0.81 | NLRP3 (0.54) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| SCHEMBL5799805 | 0.81 | NPC1 (0.58) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| SCHEMBL27889179 | 0.81 | RECQL (0.62) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 | |
| SCHEMBL11859611 | 0.81 | MAPT (0.53) | KEAP1ALDH1A1CYP19A1CYP1A1CYP1B1 |
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-20110151031-A1 | COMPOSITIONS AND METHODS FOR UTILIZING THE SAME | DBC, LLC (US) | 2011-06-23 | — | — | US | disclosed |
| WO-2010022073-A1 | COMPOSITIONS AND METHODS FOR UTILIZING THE SAME | DBC, LLC (US) | 2010-02-25 | — | — | WO | disclosed |