Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Programmed cell death protein 1' and Ligand = 'BDBM482570'   

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)	BDBM482570 (US10919852, Compound TABLE 1.269 | US11708326, Com...) Show SMILES Cc1c(OCCCN2CCC(C)(O)CC2)cccc1-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/C46H50ClN5O5/c1-30-36(6-4-9-41(30)55-19-5-16-52-17-14-46(2,54)15-18-52)37-7-3-8-39-38(37)11-12-42(39)57-44-24-43(56-29-33-21-31(25-48)20-32(22-33)26-49)34(23-40(44)47)27-50-28-35-10-13-45(53)51-35/h3-4,6-9,20-24,35,42,50,54H,5,10-19,27-29H2,1-2H3,(H,51,53)/t35-,42-/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
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