Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 517.7 BDBM365754

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))	BDBM365754 (({2,6-dimethoxy-4-[(2-methyl-3- phenylphenyl)metho...) Show SMILES COc1cc(OCc2cccc(c2C)-c2ccccc2)cc(OC)c1CNC(C)(C)CN1CCN(C)CC1 Show InChI InChI=1S/C32H43N3O3/c1-24-26(13-10-14-28(24)25-11-8-7-9-12-25)22-38-27-19-30(36-5)29(31(20-27)37-6)21-33-32(2,3)23-35-17-15-34(4)16-18-35/h7-14,19-20,33H,15-18,21-23H2,1-6H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharmaceuticals					Assay Description All binding studies were performed in an HTRF assay buffer consisting of dPBS supplemented with 0.1% (withv) bovine serum albumin and 0.05% (v/v) Twe...				J Med Chem 51: 4-16 (2008) BindingDB Entry DOI: 10.7270/Q2RN3B42
					More data for this Ligand-Target Pair