Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 429.5 BDBM365808

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))	BDBM365808 ((2S)-1-({4-methyl-3-[(2-methyl- 3-phenylphenyl)met...) Show SMILES Cc1ccc(CN2CCCC[C@H]2C(O)=O)cc1OCc1cccc(c1C)-c1ccccc1 |r| Show InChI InChI=1S/C28H31NO3/c1-20-14-15-22(18-29-16-7-6-13-26(29)28(30)31)17-27(20)32-19-24-11-8-12-25(21(24)2)23-9-4-3-5-10-23/h3-5,8-12,14-15,17,26H,6-7,13,16,18-19H2,1-2H3,(H,30,31)/t26-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	555	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