BDBM109707 US8609715, B-64

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

InChI Key: InChIKey=NLKPKGISPLOPLB-ZDUSSCGKSA-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 = 109707   

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
Enteropeptidase (Homo sapiens (Human))	BDBM109707 (US8609715, B-64) Show SMILES CC(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/C21H22FN3O7S/c1-21(2,20(31)25-13(18(28)29)8-16(26)27)9-11-4-6-15(33-11)19(30)32-14-5-3-10(17(23)24)7-12(14)22/h3-7,13H,8-9H2,1-2H3,(H3,23,24)(H,25,31)(H,26,27)(H,28,29)/t13-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	US Patent	0.140	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
Serine protease 1 (Homo sapiens (Human))	BDBM109707 (US8609715, B-64) Show SMILES CC(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/C21H22FN3O7S/c1-21(2,20(31)25-13(18(28)29)8-16(26)27)9-11-4-6-15(33-11)19(30)32-14-5-3-10(17(23)24)7-12(14)22/h3-7,13H,8-9H2,1-2H3,(H3,23,24)(H,25,31)(H,26,27)(H,28,29)/t13-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	US Patent	0.600	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