Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 609.6 BDBM363368

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))	BDBM363368 ((S)-4-(2-((5-cyanopyridin-3-yl)methoxy)-4-(3-(2,3-...) Show SMILES Cc1cc(CNC[C@@H](O)CC(O)=O)c(OCc2cncc(c2)C#N)cc1OCc1cccc(c1C)-c1ccc2OCCOc2c1 |r| Show InChI InChI=1S/C35H35N3O7/c1-22-10-28(18-38-19-29(39)13-35(40)41)33(44-20-25-11-24(15-36)16-37-17-25)14-32(22)45-21-27-4-3-5-30(23(27)2)26-6-7-31-34(12-26)43-9-8-42-31/h3-7,10-12,14,16-17,29,38-39H,8-9,13,18-21H2,1-2H3,(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