Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 2/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | THRB | P10828 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | GLA | P06280 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | GFER | P55789 | 1/20 | 0.58 |
| ▸ | NOS3 | P29474 | 1/20 | 0.56 |
| ▸ | NOS1 | P29475 | 1/20 | 0.56 |
| ▸ | NOS2 | P35228 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7806984 | 1.00 | ATM (0.68) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL27505819 | 0.94 | ALDH1A1 (0.68) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL27505818 | 0.94 | ALDH1A1 (0.68) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL23766670 | 0.90 | ATM (0.65) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL329686 | 0.89 | ALDH1A1 (0.74) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL7460396 | 0.89 | POLB (0.64) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL7151822 | 0.89 | ALDH1A1 (0.74) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL13968379 | 0.89 | ALDH1A1 (0.62) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL13968376 | 0.89 | POLB (0.57) | ATMALDH1A1CYP2C9CYP2C19THRB | |
| SCHEMBL17923770 | 0.88 | TSHR (0.57) | ATMALDH1A1CYP2C9CYP2C19THRB |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1196686-C | Method for storing quaternary ammonium salt | TOKUYAMA CORP (JP) | 2005-04-13 | — | — | CN | disclosed |
| US-6852856-B2 | Method for preserving quaternary ammonium salt | TOKUYAMA CORPORATION (JP) | 2005-02-08 | — | — | US | disclosed |
| CN-1372554-A | Method for preserving quaternary ammonium salts | TOKUYAMA CORP (JP) | 2002-10-02 | — | — | CN | disclosed |
| US-6458948-B1 | MIXING A QUATERNARY AMMONIUM SALT HAVING A PARTICULAR TRIAZINE RING IN THE MOLECULES THEREOF, A CARBOXYLIC ACID COMPOUND AND A COMPOUND HAVING A NUCLEOPHILIC FUNCTIONAL GROUP, TO CONDENSE THE CARBOXYLIC ACID WITH THE COMPOUND HAVING THE NUCLEOPHILIC | TOKUYAMA CORPORATION (JP) | 2002-10-01 | — | — | US | disclosed |
| CN-1091088-C | Process for the preparation of alpha-haloketones, alpha-halohydrins and epoxides | KANEKA CHEMICAL CORP (JP) | 2002-09-18 | — | — | CN | disclosed |
| EP-0754669-B1 | PROCESSES FOR PRODUCING ALPHA-HALO KETONES, ALPHA-HALOHYDRINS AND EPOXIDES | KANEKA CORP (JP) | 2001-10-31 | — | — | EP | disclosed |
| EP-0710651-B1 | Process for the preparation of a decahydroisoquinoline-alpha, alpha' diamino alcohol | HOFFMANN LA ROCHE (CH) | 2001-01-17 | — | — | EP | disclosed |
| EP-0703209-B1 | Process for the preparation of halogenated alpha-amino-ketones and alpha-amino-alcohols | HOFFMANN LA ROCHE (CH) | 2001-01-17 | — | — | EP | disclosed |
| US-5929284-A | REACTING CARBOXYLIC ACID DERIVATIVE AND METAL ENOLATE PREPARED FROM ALPHA-HALOACETIC ACID, DECARBOXYLATING REACTION PRODUCT IN SITU TO PRODUCE ALPHA-HALO KETONE | KANEKA CORPORATION (JP) | 1999-07-27 | — | — | US | disclosed |
| US-5847144-A | Process for manufacturing α,α'-diaminoalcohol | HOFFMANN-LA ROCHE INC. (US) | 1998-12-08 | — | — | US | disclosed |
| CN-1146760-A | Processes for producing 'alpha'-halo ketones, 'alpha'-halohydrine and epoxides | KANEKA CORP (JP) | 1997-04-02 | — | — | CN | disclosed |
| EP-0754669-A1 | PROCESSES FOR PRODUCING ALPHA-HALO KETONES, ALPHA-HALOHYDRINS AND EPOXIDES | KANEKA CORPORATION (JP) | 1997-01-22 | — | — | EP | disclosed |
| EP-0710651-A1 | Process for the preparation of a decahydroisoquinoline-alpha, alpha' diamino alcohol | F. Hoffmann-La Roche AG (CH) | 1996-05-08 | — | — | EP | disclosed |
| EP-0703209-A2 | Process for the preparation of halogenated alpha-amino-ketones and alpha-amino-alcohols | F. Hoffmann-La Roche AG (CH) | 1996-03-27 | — | — | EP | disclosed |
| US-3976635-A | Novel esterifying agents, and their production and use | FUJISAWA PHARMACEUTICAL CO., LTD. (JA) | 1976-08-24 | — | — | US | disclosed |