BDBM234254 US9346821, B-27

SMILES: CC(C)[C@@H](N(C)Cc1ccc(s1)C(=O)Oc1ccc(cc1F)C(N)=N)C(=O)N[C@@H](CC(O)=O)C(O)=O

InChI Key: InChIKey=AEKXZFDUXYLPAD-HNAYVOBHSA-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 = 234254   

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))	BDBM234254 (US9346821, B-27) Show SMILES CC(C)[C@@H](N(C)Cc1ccc(s1)C(=O)Oc1ccc(cc1F)C(N)=N)C(=O)N[C@@H](CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H27FN4O7S/c1-11(2)19(21(31)27-15(22(32)33)9-18(29)30)28(3)10-13-5-7-17(36-13)23(34)35-16-6-4-12(20(25)26)8-14(16)24/h4-8,11,15,19H,9-10H2,1-3H3,(H3,25,26)(H,27,31)(H,29,30)(H,32,33)/t15-,19+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	0.680	n/a	n/a	n/a	n/a	n/a	n/a	8.0	n/a
AJINOMOTO CO., INC. US Patent					Assay Description Using a 96 well plate (#3915, Costar), a test compound (25 μL), 400 mM Tris-HCl buffer (pH 8.0, 25 μL) and 0.5 mg/mL fluorescence enzyme su...				US Patent US9346821 (2016) BindingDB Entry DOI: 10.7270/Q2RB73G2
					More data for this Ligand-Target Pair
Enteropeptidase (Homo sapiens (Human))	BDBM234254 (US9346821, B-27) Show SMILES CC(C)[C@@H](N(C)Cc1ccc(s1)C(=O)Oc1ccc(cc1F)C(N)=N)C(=O)N[C@@H](CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H27FN4O7S/c1-11(2)19(21(31)27-15(22(32)33)9-18(29)30)28(3)10-13-5-7-17(36-13)23(34)35-16-6-4-12(20(25)26)8-14(16)24/h4-8,11,15,19H,9-10H2,1-3H3,(H3,25,26)(H,27,31)(H,29,30)(H,32,33)/t15-,19+/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	0.780	n/a	n/a	n/a	n/a	n/a	n/a	8.0	n/a
AJINOMOTO CO., INC. US Patent					Assay Description Using a 96 well plate (#3915, Costar), a test compound (25 μL) was mixed with 20 μM fluorescence enzyme substrate (Boc-Phe-Ser-Arg-AMC, 50 ...				US Patent US9346821 (2016) BindingDB Entry DOI: 10.7270/Q2RB73G2
					More data for this Ligand-Target Pair