Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Programmed cell death 1 ligand 1' and Ligand = 'BDBM482539'   

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))	BDBM482539 (US10919852, Compound TABLE 1.238 | US11708326, Com...) Show SMILES FC1CC2(C1)CN(CCCOc1cccc(c1Cl)-c1cccc3[C@H](CCc13)Oc1cc(OCc3cncc(c3)C#N)c(CNC[C@H]3CCC(=O)N3)cc1Cl)C2 |r| Show InChI InChI=1S/C43H44Cl2FN5O4/c44-36-15-29(22-49-23-31-8-11-41(52)50-31)39(54-24-28-14-27(19-47)20-48-21-28)16-40(36)55-37-10-9-33-32(4-1-5-34(33)37)35-6-2-7-38(42(35)45)53-13-3-12-51-25-43(26-51)17-30(46)18-43/h1-2,4-7,14-16,20-21,30-31,37,49H,3,8-13,17-18,22-26H2,(H,50,52)/t31-,37+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q22N56DJ
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