BDBM109710 US8609715, C-4

SMILES: CC(Cc1ncc(s1)C(=O)Oc1ccc(cc1F)C(N)=N)C(=O)N[C@@H](CC(O)=O)C(O)=O

InChI Key: InChIKey=DBKBHOJMFKSRDI-LYNSQETBSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 109710   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Trypsin-1 (Homo sapiens (Human))	BDBM109710 (US8609715, C-4) Show SMILES CC(Cc1ncc(s1)C(=O)Oc1ccc(cc1F)C(N)=N)C(=O)N[C@@H](CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C19H19FN4O7S/c1-8(17(27)24-11(18(28)29)6-15(25)26)4-14-23-7-13(32-14)19(30)31-12-3-2-9(16(21)22)5-10(12)20/h2-3,5,7-8,11H,4,6H2,1H3,(H3,21,22)(H,24,27)(H,25,26)(H,28,29)/t8?,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	0.200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ajinomoto Co., Inc. US Patent					Assay Description Inhibition assay using human trysin.				US Patent US8609715 (2013) BindingDB Entry DOI: 10.7270/Q2Z31X9X
					More data for this Ligand-Target Pair
Enteropeptidase (Homo sapiens (Human))	BDBM109710 (US8609715, C-4) Show SMILES CC(Cc1ncc(s1)C(=O)Oc1ccc(cc1F)C(N)=N)C(=O)N[C@@H](CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C19H19FN4O7S/c1-8(17(27)24-11(18(28)29)6-15(25)26)4-14-23-7-13(32-14)19(30)31-12-3-2-9(16(21)22)5-10(12)20/h2-3,5,7-8,11H,4,6H2,1H3,(H3,21,22)(H,24,27)(H,25,26)(H,28,29)/t8?,11-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	3.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ajinomoto Co., Inc. US Patent					Assay Description Inhibition assay using human enteropeptidase.				US Patent US8609715 (2013) BindingDB Entry DOI: 10.7270/Q2Z31X9X
					More data for this Ligand-Target Pair