BDBM476968 SARS-CoV-2 3CLP and CoV inhibitor 15h

SMILES: COc1cccc2[nH]c(cc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C[C@@H]1CCCNC1=O)C(=O)COC(=O)c1c(cccc1C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=PKJWLVLOGHATRZ-UHFFFAOYSA-N

Data: 3 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 476968   

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)	BDBM476968 (SARS-CoV-2 3CLP and CoV inhibitor 15h) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
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Cathepsin B (Human)	BDBM476968 (SARS-CoV-2 3CLP and CoV inhibitor 15h) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	464	n/a	n/a	n/a	n/a	n/a	n/a
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Cathepsin S (Human)	BDBM476968 (SARS-CoV-2 3CLP and CoV inhibitor 15h) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	116	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair