BDBM50317182 2-[12-(beta-Carboline-2-ium-2-yl)dodecyl]-beta-carboline-2-ium dibromide::CHEMBL1088377
SMILES: C(CCCCCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCCCC[n+]1ccc2c(c1)[nH]c1ccccc21
InChI Key: InChIKey=VCJGRMVHAYBWRI-UHFFFAOYSA-P
Data: 4 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
GluN1/GluN2B NMDA receptor (Homo sapiens (Human)) | BDBM50317182 (2-[12-(beta-Carboline-2-ium-2-yl)dodecyl]-beta-car...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Schiller-Universitat Jena Curated by ChEMBL | Assay Description Inhibition of dexamethasone-induced human NR1-1a/NR2B receptor-mediated excitotoxicity in (S)-glutamate/glycine-stimulated mouse L13-E6 cells assesse... | J Med Chem 53: 3611-7 (2010) Article DOI: 10.1021/jm1000024 BindingDB Entry DOI: 10.7270/Q2SJ1KS0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50317182 (2-[12-(beta-Carboline-2-ium-2-yl)dodecyl]-beta-car...) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 86 | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Schiller-Universitat Jena Curated by ChEMBL | Assay Description Inhibition of electric eel AChE by modified Ellman's method | J Med Chem 53: 3611-7 (2010) Article DOI: 10.1021/jm1000024 BindingDB Entry DOI: 10.7270/Q2SJ1KS0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Butyrylcholinesterase (BuChE) (Equus caballus (Horse)) | BDBM50317182 (2-[12-(beta-Carboline-2-ium-2-yl)dodecyl]-beta-car...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Schiller-Universitat Jena Curated by ChEMBL | Assay Description Inhibition of equine serum BChE by modified Ellman's method | J Med Chem 53: 3611-7 (2010) Article DOI: 10.1021/jm1000024 BindingDB Entry DOI: 10.7270/Q2SJ1KS0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
NR1/NR2A (Homo sapiens (Human)) | BDBM50317182 (2-[12-(beta-Carboline-2-ium-2-yl)dodecyl]-beta-car...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Schiller-Universitat Jena Curated by ChEMBL | Assay Description Inhibition of dexamethasone-induced human NR1-1a/NR2A receptor-mediated excitotoxicity in (S)-glutamate/glycine-stimulated mouse L12-G10 cells assess... | J Med Chem 53: 3611-7 (2010) Article DOI: 10.1021/jm1000024 BindingDB Entry DOI: 10.7270/Q2SJ1KS0 | |||||||||||
More data for this Ligand-Target Pair |