Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 616.5 BDBM363409

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))	BDBM363409 (5-((4-bromo-5-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6...) Show SMILES Cc1c(COc2cc(OCc3cncc(c3)C#N)c(CNCCO)cc2Br)cccc1-c1ccc2OCCOc2c1 Show InChI InChI=1S/C32H30BrN3O5/c1-21-25(3-2-4-27(21)24-5-6-29-32(13-24)39-10-9-38-29)20-41-31-14-30(26(12-28(31)33)18-35-7-8-37)40-19-23-11-22(15-34)16-36-17-23/h2-6,11-14,16-17,35,37H,7-10,18-20H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	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