Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.74 |
| ▸ | CES1 | P23141 | 1/20 | 0.74 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.61 |
| ▸ | FNTA | P49354 | 1/20 | 0.61 |
| ▸ | FNTB | P49356 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.57 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.56 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4279627 | 0.91 | KEAP1 (0.73) | CES2CES1KEAP1ALDH1A1FFAR1 | |
| SCHEMBL574185 | 0.86 | CES1 (1.00) | CES2CES1FNTAFNTBALDH1A1 | |
| Hydrochloric Acid SCHEMBL3111570 | 0.84 | CES1 (0.94) | CES2CES1FNTAFNTBALDH1A1 | |
| SCHEMBL4643571 | 0.83 | CES1 (0.74) | CES2CES1KEAP1FNTAFNTB | |
| SCHEMBL5566614 | 0.83 | HDAC1 (0.69) | KEAP1ALDH1A1FFAR1PLAAT5PLAAT4 | |
| SCHEMBL258545 | 0.82 | KEAP1 (0.67) | CES2CES1KEAP1ALDH1A1FFAR1 | |
| SCHEMBL29078123 | 0.82 | KEAP1 (0.67) | CES2CES1KEAP1ALDH1A1FFAR1 | |
| SCHEMBL4645204 | 0.81 | CES1 (0.71) | CES2CES1KEAP1FNTAFNTB | |
| SCHEMBL12950241 | 0.81 | ALDH1A1 (0.61) | CES2CES1KEAP1ALDH1A1FFAR1 | |
| SCHEMBL6010224 | 0.81 | CES2 (0.71) | CES2CES1FNTAFNTBALDH1A1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1119868-A | Rare earth compounds and their preparation | TIMOTHY JOHN LEEDHAM (FR) | 1996-04-03 | — | — | CN | claimed |
| US-5504195-A | RARE EARTH METAL COMPLEXES WITH BETA-DIKETONE LIGANDS AND POLYETHER OR POLYAMINE COMPOUNDS; METAL OXIDE PRECURSORS | RHONE-POULENC CHIMIE (FR) | 1996-04-02 | — | — | US | claimed |
| EP-0680483-A1 | RARE EARTH COMPOUNDS AND THEIR PREPARATION | RHONE-POULENC CHIMIE (FR) | 1995-11-08 | — | — | EP | claimed |
| WO-1994017078-A1 | RARE EARTH COMPOUNDS AND THEIR PREPARATION | RHONE-POULENC CHIMIE (FR) | 1994-08-04 | — | — | WO | claimed |
| EP-1397364-A1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | ELI LILLY AND COMPANY (US) | 2004-03-17 | — | — | EP | disclosed |
| WO-2002094833-A1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | ELI LILLY AND COMPANY (US) | 2002-11-28 | — | — | WO | disclosed |
| CN-1119868-A | Rare earth compounds and their preparation | TIMOTHY JOHN LEEDHAM (FR) | 1996-04-03 | — | — | CN | disclosed |
| US-5504195-A | RARE EARTH METAL COMPLEXES WITH BETA-DIKETONE LIGANDS AND POLYETHER OR POLYAMINE COMPOUNDS; METAL OXIDE PRECURSORS | RHONE-POULENC CHIMIE (FR) | 1996-04-02 | — | — | US | disclosed |
| EP-0680483-A1 | RARE EARTH COMPOUNDS AND THEIR PREPARATION | RHONE-POULENC CHIMIE (FR) | 1995-11-08 | — | — | EP | disclosed |
| WO-1994017078-A1 | RARE EARTH COMPOUNDS AND THEIR PREPARATION | RHONE-POULENC CHIMIE (FR) | 1994-08-04 | — | — | WO | disclosed |