BDBM50308754 3-(Methyl-N-ethylcarbamate)-6,7-dichloro-5,8-dimethoxybenz[f]indazol-4,9-dione::CHEMBL591062
SMILES: COC(=O)NCCc1n[nH]c2c1C(=O)c1c(OC)c(Cl)c(Cl)c(OC)c1C2=O
InChI Key: InChIKey=JPZQPQKEEWNUEC-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Carbonyl reductase [NADPH] 1 (Homo sapiens (Human)) | BDBM50308754 (3-(Methyl-N-ethylcarbamate)-6,7-dichloro-5,8-dimet...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Howard University Curated by ChEMBL | Assay Description Displacement of menadione from human recombinant CBR expressed in Escherichia coli BL21 (DE3) | Bioorg Med Chem 18: 134-41 (2010) Article DOI: 10.1016/j.bmc.2009.11.011 BindingDB Entry DOI: 10.7270/Q2XG9R7G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonyl reductase [NADPH] 1 (Homo sapiens (Human)) | BDBM50308754 (3-(Methyl-N-ethylcarbamate)-6,7-dichloro-5,8-dimet...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Howard University Curated by ChEMBL | Assay Description Displacement of daunorubicin from human recombinant CBR expressed in Escherichia coli BL21 (DE3) | Bioorg Med Chem 18: 134-41 (2010) Article DOI: 10.1016/j.bmc.2009.11.011 BindingDB Entry DOI: 10.7270/Q2XG9R7G | |||||||||||
More data for this Ligand-Target Pair |