BDBM50197300 CHEMBL3912164::ebselen derivative 2e

SMILES: COc1ccccc1NC(=O)c1ccccc1[Se][Se]c1ccccc1C(=O)Nc1ccccc1OC

InChI Key: InChIKey=WNFPBFJRJMQTGX-UHFFFAOYSA-N

Data: 2 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50197300   

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
Replicase polyprotein 1ab (2019-nCoV)	BDBM50197300 (CHEMBL3912164 | ebselen derivative 2e) Show SMILES COc1ccccc1NC(=O)c1ccccc1[Se][Se]c1ccccc1C(=O)Nc1ccccc1OC Show InChI InChI=1S/C28H24N2O4Se2/c1-33-23-15-7-5-13-21(23)29-27(31)19-11-3-9-17-25(19)35-36-26-18-10-4-12-20(26)28(32)30-22-14-6-8-16-24(22)34-2/h3-18H,1-2H3,(H,29,31)(H,30,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank GoogleScholar	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	263	n/a	n/a	n/a	n/a	n/a	n/a
University ofAmsterdam					Assay Description The inhibitor was screened against recombinant PL​pro​SARS and PL​pro​CoV2 at 37°Cin the assay buffer as described above. For...				bioRxiv 1-12 (2020) BindingDB Entry DOI: 10.7270/Q2RX9FGT
					More data for this Ligand-Target Pair
Microtubule-associated protein 2 (Homo sapiens (Human))	BDBM50197300 (CHEMBL3912164 | ebselen derivative 2e) Show SMILES COc1ccccc1NC(=O)c1ccccc1[Se][Se]c1ccccc1C(=O)Nc1ccccc1OC Show InChI InChI=1S/C28H24N2O4Se2/c1-33-23-15-7-5-13-21(23)29-27(31)19-11-3-9-17-25(19)35-36-26-18-10-4-12-20(26)28(32)30-22-14-6-8-16-24(22)34-2/h3-18H,1-2H3,(H,29,31)(H,30,32)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wroclaw University of Technology Curated by ChEMBL					Assay Description Non-covalent/mixed type inhibition of recombinant human MetAP2 using Met-AMC as substrate preincubated for 30 mins followed by substrate addition by ...				Bioorg Med Chem Lett 26: 5254-5259 (2016) Article DOI: 10.1016/j.bmcl.2016.09.050 BindingDB Entry DOI: 10.7270/Q28917T7
					More data for this Ligand-Target Pair