Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 586.6 BDBM540868

Wt: 586.6 BDBM540869

Wt: 586.6 BDBM540994

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Programmed cell death 1 ligand 1 (Homo sapiens (Human))	BDBM540868 (US11266643, Compound 1.038) Show SMILES COc1cc(cc(F)c1CN[C@@H]1CCOC1)-c1cccc(c1C)-c1cccc(NC(=O)c2cn(C)c(=O)n(C)c2=O)c1C |r| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description 96 Well plates were coated with 111 g/mL of human PD-L1 (obtained from R&D) in PBS overnight at 4° C. The wells were then blocked with 2% BSA in PBS ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21V5J4V
					More data for this Ligand-Target Pair
Programmed cell death 1 ligand 1 (Homo sapiens (Human))	BDBM540994 (US11266643, Compound 1.162) Show SMILES COc1cc(cc(F)c1CNC1CCOC1)-c1cccc(c1C)-c1cccc(NC(=O)c2cn(C)c(=O)n(C)c2=O)c1C Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description 96 Well plates were coated with 111 g/mL of human PD-L1 (obtained from R&D) in PBS overnight at 4° C. The wells were then blocked with 2% BSA in PBS ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21V5J4V
					More data for this Ligand-Target Pair
Programmed cell death 1 ligand 1 (Homo sapiens (Human))	BDBM540869 (US11266643, Compound 1.039) Show SMILES COc1cc(cc(F)c1CN[C@H]1CCOC1)-c1cccc(c1C)-c1cccc(NC(=O)c2cn(C)c(=O)n(C)c2=O)c1C |r| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description 96 Well plates were coated with 111 g/mL of human PD-L1 (obtained from R&D) in PBS overnight at 4° C. The wells were then blocked with 2% BSA in PBS ...				Citation and Details BindingDB Entry DOI: 10.7270/Q21V5J4V
					More data for this Ligand-Target Pair