Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.40 |
| ▸ | CACNB1 | Q02641 | 2/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9055063 | 0.87 | CES2 (0.50) | CES2CES1LMNAPOLBHTT | |
| SCHEMBL9276316 | 0.84 | CES2 (0.47) | CES2CES1LMNAALDH1A1KDM4E | |
| SCHEMBL959019 | 0.82 | CES2 (0.57) | CES2CES1LMNAPOLBALDH1A1 | |
| SCHEMBL3813014 | 0.82 | CES2 (0.42) | CES2CES1LMNAPOLBHTT | |
| SCHEMBL11484333 | 0.79 | CES2 (0.44) | CES2CES1HTTALDH1A1KDM4E | |
| SCHEMBL5999756 | 0.79 | CES2 (0.53) | CES2CES1LMNAALDH1A1KDM4E | |
| SCHEMBL29130635 | 0.78 | CES2 (0.52) | CES2CES1LMNAHTTALDH1A1 | |
| SCHEMBL29110206 | 0.77 | KMT2A (0.45) | LMNAPOLBHTTALDH1A1KDM4E | |
| SCHEMBL17947804 | 0.77 | LMNA (0.41) | CES2CES1LMNAPOLBHTT | |
| SCHEMBL9055039 | 0.77 | CES2 (0.50) | CES2CES1LMNAHTTALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6040484-A | HYDROXYLATION OF PHENOLIC COMPOUNDS USING HYDROGEN PEROXIDE AND A CATALYST OF AT LEAST ONE RARE EARTH OR BISMUTH TRIFLATE; CATALYST SELECTIVITY | RHODIA CHIMIE (FR) | 2000-03-21 | — | — | US | claimed |
| US-5331103-A | Reaction with hydrogen peroxide, hydroquinone from phenol | RHONE-POULENC CHIMIE (FR) | 1994-07-19 | — | — | US | claimed |
| US-6040484-A | HYDROXYLATION OF PHENOLIC COMPOUNDS USING HYDROGEN PEROXIDE AND A CATALYST OF AT LEAST ONE RARE EARTH OR BISMUTH TRIFLATE; CATALYST SELECTIVITY | RHODIA CHIMIE (FR) | 2000-03-21 | — | — | US | disclosed |
| US-5331103-A | Reaction with hydrogen peroxide, hydroquinone from phenol | RHONE-POULENC CHIMIE (FR) | 1994-07-19 | — | — | US | disclosed |