BDBM496864 SARS-CoV-2 PLpro Inhibitor, 94::US20240166598, Example 91

SMILES: C[C@@H](NC(=O)c1cc(NC2CNC2)ccc1C)c1cccc(c1)-c1ccc(CN[C@H]2CC[C@@H](O)C2)s1

InChI Key: InChIKey=IGVYCVBUHQMNRZ-UHFFFAOYSA-N

Data: 3 IC50  2 Kd

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 496864   

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)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (2019-nCoV)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1a (2019-nCoV)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM496864 (SARS-CoV-2 PLpro Inhibitor, 94 | US20240166598, Ex...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair