Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Programmed cell death protein 1' and Ligand = 'BDBM482583'   

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 protein 1 (Homo sapiens)	BDBM482583 (US10919852, Compound TABLE 1.282 | US11708326, Com...) Show SMILES C[C@H]1CCCCN1CCCOc1cccc(c1C)-c1cccc2[C@H](CCc12)Oc1cc(OCc2cc(cc(c2)C#N)C#N)c(CNC[C@@H]2CCC(=O)N2)cc1Cl |r| Show InChI InChI=1S/C46H50ClN5O4/c1-30-8-3-4-17-52(30)18-7-19-54-42-12-6-9-37(31(42)2)38-10-5-11-40-39(38)14-15-43(40)56-45-24-44(55-29-34-21-32(25-48)20-33(22-34)26-49)35(23-41(45)47)27-50-28-36-13-16-46(53)51-36/h5-6,9-12,20-24,30,36,43,50H,3-4,7-8,13-19,27-29H2,1-2H3,(H,51,53)/t30-,36-,43-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<5	n/a	n/a	n/a	n/a	n/a	n/a
ChemoCentryx, Inc. US Patent					Assay Description 96 Well plates were coated with 1 g/mL of human PD-L1 (obtained from R&D) in PBS overnight at 4° C. The wells were then blocked with 2% BSA in PBS (W...				US Patent US10919852 (2021) BindingDB Entry DOI: 10.7270/Q2RF5Z3R
					More data for this Ligand-Target Pair