Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 9' and Ligand = 'BDBM213831'   

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
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM213831 (SLRFLYEG) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(O)=O |r| Show InChI InChI=1S/C46H69N11O13/c1-25(2)19-33(54-39(64)30(47)24-58)42(67)52-31(11-8-18-50-46(48)49)41(66)56-35(21-27-9-6-5-7-10-27)45(70)55-34(20-26(3)4)43(68)57-36(22-28-12-14-29(59)15-13-28)44(69)53-32(16-17-37(60)61)40(65)51-23-38(62)63/h5-7,9-10,12-15,25-26,30-36,58-59H,8,11,16-24,47H2,1-4H3,(H,51,65)(H,52,67)(H,53,69)(H,54,64)(H,55,70)(H,56,66)(H,57,68)(H,60,61)(H,62,63)(H4,48,49,50)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	170	-35.9	n/a	n/a	n/a	n/a	n/a	n/a	4
Georg-August-University of Goettingen					Assay Description All assays were performed in TB supplemented with 0.2% Tween 20. For inhibition assays, recombinant DPP9 (25 nM) purified from insect cells was incub...				J Biol Chem 288: 32787-96 (2013) Article DOI: 10.1074/jbc.M113.489179 BindingDB Entry DOI: 10.7270/Q2VX0FBJ
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