BindingDB BDBM11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine

BDBM11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine

SMILES CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C

InChI Key InChIKey=XSVMFMHYUFZWBK-NSHDSACASA-N

Data 2 KI 112 IC50 1 Kd

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 11682

Acetylcholinesterase(Homo sapiens (Human))
Indian Institute Of Technology (Banaras Hindu University)

Curated by ChEMBL

BDBM11682(2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethyl...)

IC50: 1.68E+3nMAssay Description:Inhibition of human AChE by Ellman's methodMore data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

Purchase DrugBank MCE
KEGG PC cid PC sid Similars

Details Article PubMed DrugBank

Cholinesterase(Homo sapiens (Human))
Indian Institute Of Technology (Banaras Hindu University)

Curated by ChEMBL

BDBM11682(2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethyl...)

IC50: 1.22E+3nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

Purchase DrugBank MCE
KEGG PC cid PC sid Similars

Details Article PubMed DrugBank

Filter my 115 hits

Targets 6▿
- Acetylcholinesterase 61
- Cholinesterase 47
- Carboxylic ester hydrolase 4
- Sodium-dependent serotonin transporter 1
- Amine oxidase [flavin-containing] B 1
- Acetylcholine receptor subunit epsilon 1
Publications 50▿
- Eur J Med Chem 187: (2020) 4
- Eur J Med Chem 223: (2021) 4
- Bioorg Med Chem 27: 895-930 (2019) 4
- Bioorg Med Chem Lett 60: (2022) 4
- J Med Chem 59: 7683-9 (2016) 4
- Eur J Med Chem 194: (2020) 4
- Bioorg Med Chem 35: (2021) 3
- J Med Chem 62: 8881-8914 (2019) 3
- Bioorg Med Chem 26: 6115-6127 (2018) 3
- Eur J Med Chem 197: (2020) 3
- Bioorg Med Chem Lett 77: (2022) 2
- Eur J Med Chem 231: (2022) 2
- Bioorg Med Chem 28: (2020) 2
- Eur J Med Chem 183: (2019) 2
- Eur J Med Chem 178: 726-739 (2019) 2
- RSC Med Chem 13: 944-954 (2022) 2
- J Med Chem 62: 9116-9140 (2019) 2
- Bioorg Med Chem Lett 30: (2020) 2
- Eur J Med Chem 107: 219-32 (2016) 2
- J Med Chem 65: 12292-12318 (2022) 2
- Eur J Med Chem 126: 823-843 (2017) 2
- Eur J Med Chem 125: 1200-1212 (2017) 2
- Eur J Med Chem 156: 598-617 (2018) 2
- Eur J Med Chem 126: 810-822 (2017) 2
- Eur J Med Chem 122: 557-573 (2016) 2
- Bioorg Med Chem 40: (2021) 2
- Eur J Med Chem 201: (2020) 2
- Bioorg Med Chem 28: (2020) 2
- Bioorg Med Chem 28: (2020) 2
- Eur J Med Chem 200: (2020) 2
- Eur J Med Chem 222: (2021) 2
- Eur J Med Chem 119: 260-77 (2016) 2
- Eur J Med Chem 181: (2019) 2
- Eur J Med Chem 210: (2021) 2
- Bioorg Med Chem 25: 360-371 (2017) 2
- J Med Chem 59: 6387-406 (2016) 2
- J Med Chem 61: 119-139 (2018) 2
- Eur J Med Chem 167: 510-524 (2019) 2
- Eur J Med Chem 166: 90-107 (2019) 2
- Bioorg Med Chem 25: 1352-1363 (2017) 2
- US Patent US9586925 (2017) 2
- Bioorg Med Chem Lett 26: 2035-9 (2016) 1
- Bioorg Med Chem Lett 26: 1624-8 (2016) 1
- Eur J Med Chem 230: (2022) 1
- Bioorg Med Chem 25: 1030-1041 (2017) 1
- Bioorg Med Chem 26: 3731-3762 (2018) 1
- Eur J Med Chem 168: 207-220 (2019) 1
- Eur J Med Chem 225: (2021) 1
- Eur J Med Chem 141: 232-239 (2017) 1
- J Med Chem 49: 5051-8 (2006) 1
- ...
Institutions 40▿
- Nanyang Normal University 14
- Anhui Medical University 8
- Sichuan University 5
- The University of Queensland 4
- Indian Institute Of Technology (Banaras Hindu University) 4
- University of Ljubljana 4
- Csir-Central Drug Research Institute 4
- Guizhou Medical University 4
- China Pharmaceutical University 3
- University Of Ljubljana 3
- Julius Maximilian University W£Rzburg 2
- Nobel IlaÇ 2
- University Institute Of Pharmaceutical Sciences 2
- Mansoura University 2
- Jamia Millia Islamia (Central University) 2
- Yeditepe University 2
- South China University Of Technology 2
- Normandie Univ 2
- Tehran University of Medical Sciences 2
- Agri Ibrahim Cecen University 2
- Northwest A&F University 2
- Bezmialem Vakif University 2
- University Of Waterloo 2
- Hu'Nan University 2
- Jinan University 2
- Instituto De Qu£Mica M£Dica (Csic) 2
- Julius Maximilian University Of W�Rzburg 2
- Alma Mater Studiorum-University Of Bologna 2
- The Behrend College 2
- Hebei University 2
- Yogi Vemana University 2
- Shanghai Jiao Tong University (Sjtu) 2
- Indian Institute of Technology (Banaras Hindu University) 2
- Henan University 2
- University Of British Columbia 1
- Abbottabad University of Science and Technology 1
- University of Pisa 1
- Chinese Academy of Medical Sciences and Peking Union Medical College 1
- Jagiellonian University Medical College 1
- Istituto Di Cristallografia 1
- ...
Affinity: 14 to 2.8E+5 nM▿
- Ki 2
- IC50 112
- Kd 1
- Affinity ≤ nM
Xtal structures: 0
Docked structures: 0
Catalog Cmpds: 1