BDBM50428474 DITIOCARB::Diethyldithiocarbamate
SMILES: CCN(CC)C(S)=S
InChI Key: InChIKey=LMBWSYZSUOEYSN-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Carbonic anhydrase 1 (Homo sapiens (Human)) | BDBM50428474![]() (DITIOCARB | Diethyldithiocarbamate) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | Purchase DrugBank KEGG MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 7.90E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze Curated by ChEMBL | Assay Description Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped-flow CO2 hydration assay | Bioorg Med Chem Lett 26: 1406-10 (2016) Article DOI: 10.1016/j.bmcl.2016.01.072 BindingDB Entry DOI: 10.7270/Q2W95C24 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 2 (Homo sapiens (Human)) | BDBM50428474![]() (DITIOCARB | Diethyldithiocarbamate) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | Purchase DrugBank KEGG MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 3.10E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Istituto di Biochimica delle Proteine (IBP) Curated by ChEMBL | Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by CO2 hydration stopped-flow assay | Bioorg Med Chem 21: 1465-9 (2013) Article DOI: 10.1016/j.bmc.2012.09.047 BindingDB Entry DOI: 10.7270/Q20R9QQQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 2 (Homo sapiens (Human)) | BDBM50428474![]() (DITIOCARB | Diethyldithiocarbamate) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | Purchase DrugBank KEGG MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 3.10E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze Curated by ChEMBL | Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydration assay | Bioorg Med Chem Lett 26: 1406-10 (2016) Article DOI: 10.1016/j.bmcl.2016.01.072 BindingDB Entry DOI: 10.7270/Q2W95C24 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bile salt export pump (Homo sapiens (Human)) | BDBM50428474![]() (DITIOCARB | Diethyldithiocarbamate) | PDB Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar | Purchase DrugBank KEGG MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 6.93E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca Curated by ChEMBL | Assay Description Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-... | Drug Metab Dispos 40: 2332-41 (2012) Article DOI: 10.1124/dmd.112.047068 BindingDB Entry DOI: 10.7270/Q2ZP488M | |||||||||||
More data for this Ligand-Target Pair |