Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 608.6 BDBM363066

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

Found 1 hit 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))	BDBM363066 ((S)-4-(2-(3-cyanobenzyloxy)-4-(3-(2,3-dihydrobenzo...) Show SMILES Cc1cc(OCc2cccc(c2C)-c2ccc3OCCOc3c2)cc(OCc2cccc(c2)C#N)c1CNC[C@@H](O)CC(O)=O |r| Show InChI InChI=1S/C36H36N2O7/c1-23-13-30(44-22-28-7-4-8-31(24(28)2)27-9-10-33-35(15-27)43-12-11-42-33)17-34(32(23)20-38-19-29(39)16-36(40)41)45-21-26-6-3-5-25(14-26)18-37/h3-10,13-15,17,29,38-39H,11-12,16,19-22H2,1-2H3,(H,40,41)/t29-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The interaction of PD-1 and PD-L1 can be assessed using soluble, purified preparations of the extracellular domains of the two proteins. The PD-1 and...				US Patent US9850225 (2017) BindingDB Entry DOI: 10.7270/Q2N018TZ
					More data for this Ligand-Target Pair