Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.48 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.48 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.48 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3651519 | 1.00 | CHRM1 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL3652466 | 1.00 | CHRM1 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL4729539 | 0.97 | CHRM1 (0.50) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Ethane SCHEMBL29184108 | 0.97 | CHRM1 (0.50) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL10750572 | 0.89 | CHRM1 (0.43) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL14110749 | 0.86 | TDP1 (0.60) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL5031485 | 0.86 | TDP1 (0.60) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL406135 | 0.85 | CA2 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL28212336 | 0.83 | TDP1 (0.57) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL194727 | 0.83 | GPR84 (0.54) | SLC1A2SLC1A1GRIK1GRIK2CA2 |
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 332 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118388335-A | Method for controlling impurities in valproic acid | 湖南省湘中制药有限公司 | 2024-07-26 | — | — | CN | claimed |
| CN-118373735-A | Valproic acid prepared by cyanoacetic acid ester method | 湖南省湘中制药有限公司 | 2024-07-23 | — | — | CN | claimed |
| CN-118184508-A | Method for preparing valproic acid by diethyl malonate method | 湖南省湘中制药有限公司 | 2024-06-14 | — | — | CN | claimed |
| CN-118010875-A | Detection method for impurities in valproic acid prepared by diethyl malonate method | 湖南省湘中制药有限公司 | 2024-05-10 | — | — | CN | claimed |
| CN-116947600-B | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2024-04-26 | — | — | CN | claimed |
| CN-117430509-A | Preparation and hydrolysis method of 2-alkyl-2-propyl malonic acid diester | 湖南省湘中制药有限公司 | 2024-01-23 | — | — | CN | claimed |
| CN-117430527-A | Preparation method of 2-alkyl-2-cyano valerate | 湖南省湘中制药有限公司 | 2024-01-23 | — | — | CN | claimed |
| CN-117074559-A | Detection method for impurities in valproic acid prepared by methyl cyanoacetate method | 湖南省湘中制药有限公司 | 2023-11-17 | — | — | CN | claimed |
| CN-114354803-B | Method for detecting related substances of sodium valproate oral solution | 成都倍特得诺药业有限公司 | 2023-11-14 | — | — | CN | claimed |
| CN-116947600-A | Preparation method of 2-isopropyl valeric acid as valproic acid process impurity | 湖南省湘中制药有限公司 | 2023-10-27 | — | — | CN | claimed |
| WO-2002090479-A1 | PERFUMED PARTICLES AND ARTICLES CONTAINING THE SAME | THE PROCTER & GAMBLE COMPANY (US) | 2002-11-14 | — | — | WO | claimed |
| EP-1077926-A1 | PROPYLISOPROPYL ACETIC ACID AND PROPYLISOPROPYL ACETAMIDE STEREOISOMERS, A METHOD FOR THEIR SYNTHESIS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) | 2001-02-28 | — | — | EP | claimed |
| WO-1999054282-A1 | PROPYLISOPROPYL ACETIC ACID AND PROPYLISOPROPYL ACETAMIDE STEREOISOMERS, A METHOD FOR THEIR SYNTHESIS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY (IL) | 1999-10-28 | — | — | WO | claimed |
| EP-0684221-B1 | Process for preparing carbonate esters | NIPPON CATALYTIC CHEM IND (JP) | 1997-10-15 | — | — | EP | claimed |
| US-5472682-A | Mixed with clays, anionic, nonionic, cationic, zwitterionic surfactants, excipients and water; used in diagnostic radiology | STERLING WINTHROP INC. (US) | 1995-12-05 | — | — | US | claimed |
| US-5385722-A | X-ray radiology and computer tomography; uniform coating of the soft tissues; medical diagnosis | STERLING WINTHROP INC. (US) | 1995-01-31 | — | — | US | claimed |
| EP-0617969-A2 | Compositions of iodophenyl esters and iodophenyl sulfonates for visualization of the gastrointestinal tract | NYCOMED IMAGING AS (NO) | 1994-10-05 | — | — | EP | claimed |
| EP-0617970-A2 | Compositions of iodophenyl esters and iodophenyl sulfonates in film-forming materials for visualization of the gastrointestinal tract | NYCOMED IMAGING AS (NO) | 1994-10-05 | — | — | EP | claimed |
| US-5336484-A | Contrast compound comprising an iodobenzene ester and a Group 2A metal salt of a carboxylated or sulfonated polysaccharide in a carrier; uniform coating; radiology | STERLING WINTHROP INC. (US) | 1994-08-09 | — | — | US | claimed |
| US-5318769-A | Compositions of iodophenyl esters for X-ray visualization of the gastrointestinal tract | STERLING WINTHROP INC. (US) | 1994-06-07 | — | — | US | claimed |