Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Trypsinogen 16' and Ligand = 'BDBM193310'   

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
Trypsinogen 16 (Mus musculus (Mouse))	BDBM193310 (US9199927, 21) Show SMILES NC(=N)Nc1ccc(cc1)C(=O)Oc1ccc2nc(ccc2c1)C(=O)NC(C(O)=O)c1ccccc1 Show InChI InChI=1S/C26H21N5O5/c27-26(28)29-18-9-6-16(7-10-18)25(35)36-19-11-13-20-17(14-19)8-12-21(30-20)23(32)31-22(24(33)34)15-4-2-1-3-5-15/h1-14,22H,(H,31,32)(H,33,34)(H4,27,28,29)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.170	n/a	n/a	n/a	n/a	8.0	25
Astellas Pharma Inc. US Patent					Assay Description The compound was dissolved in dimethyl sulfoxide (DMSO), and diluted to an arbitrary concentration (A). A was 100-fold diluted with a buffer (0.1 M T...				US Patent US9199927 (2015) BindingDB Entry DOI: 10.7270/Q2P26WXN
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