BDBM50253932 CHEMBL459318::Ethyl 2-(N-{2-[(4-carbamimidoylphenoxy)methyl]-2,4-dimethyl-3,4-dihydro-2H-1,4-benzoxazin-7-yl}benzamido)acetate

SMILES: CCOC(=O)CN(C(=O)c1ccccc1)c1ccc2N(C)CC(C)(COc3ccc(cc3)C(N)=N)Oc2c1

InChI Key: InChIKey=DGZFABMGTRRPRQ-UHFFFAOYSA-N

Data: 2 KI  1 IC50

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 3 hits for monomerid = 50253932   

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
Prothrombin (Homo sapiens (Human))	BDBM50253932 (CHEMBL459318 | Ethyl 2-(N-{2-[(4-carbamimidoylphen...) Show SMILES CCOC(=O)CN(C(=O)c1ccccc1)c1ccc2N(C)CC(C)(COc3ccc(cc3)C(N)=N)Oc2c1 Show InChI InChI=1S/C29H32N4O5/c1-4-36-26(34)17-33(28(35)21-8-6-5-7-9-21)22-12-15-24-25(16-22)38-29(2,18-32(24)3)19-37-23-13-10-20(11-14-23)27(30)31/h5-16H,4,17-19H2,1-3H3,(H3,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	156	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of thrombin (unknown origin)				J Med Chem 51: 5617-29 (2008) Article DOI: 10.1021/jm8003448 BindingDB Entry DOI: 10.7270/Q2JQ10TZ
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50253932 (CHEMBL459318 | Ethyl 2-(N-{2-[(4-carbamimidoylphen...) Show SMILES CCOC(=O)CN(C(=O)c1ccccc1)c1ccc2N(C)CC(C)(COc3ccc(cc3)C(N)=N)Oc2c1 Show InChI InChI=1S/C29H32N4O5/c1-4-36-26(34)17-33(28(35)21-8-6-5-7-9-21)22-12-15-24-25(16-22)38-29(2,18-32(24)3)19-37-23-13-10-20(11-14-23)27(30)31/h5-16H,4,17-19H2,1-3H3,(H3,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of factor 10a (unknown origin)				J Med Chem 51: 5617-29 (2008) Article DOI: 10.1021/jm8003448 BindingDB Entry DOI: 10.7270/Q2JQ10TZ
					More data for this Ligand-Target Pair
Integrin alpha-IIb (Homo sapiens (Human))	BDBM50253932 (CHEMBL459318 | Ethyl 2-(N-{2-[(4-carbamimidoylphen...) Show SMILES CCOC(=O)CN(C(=O)c1ccccc1)c1ccc2N(C)CC(C)(COc3ccc(cc3)C(N)=N)Oc2c1 Show InChI InChI=1S/C29H32N4O5/c1-4-36-26(34)17-33(28(35)21-8-6-5-7-9-21)22-12-15-24-25(16-22)38-29(2,18-32(24)3)19-37-23-13-10-20(11-14-23)27(30)31/h5-16H,4,17-19H2,1-3H3,(H3,30,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of fibrinogen binding to human platelet GPIIb/IIIa receptor				J Med Chem 51: 5617-29 (2008) Article DOI: 10.1021/jm8003448 BindingDB Entry DOI: 10.7270/Q2JQ10TZ
					More data for this Ligand-Target Pair