BDBM50253779 3-[2-(4-Carbamimidoylbenzyloxy)-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carbonylamino]propanoic acid::CHEMBL460567

SMILES: CN1C(=O)C(OCc2ccc(cc2)C(N)=N)Oc2cc(ccc12)C(=O)NCCC(O)=O

InChI Key: InChIKey=VWMYUWOYJWIBPV-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 = 50253779   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50253779 (3-[2-(4-Carbamimidoylbenzyloxy)-4-methyl-3-oxo-3,4...) Show SMILES CN1C(=O)C(OCc2ccc(cc2)C(N)=N)Oc2cc(ccc12)C(=O)NCCC(O)=O Show InChI InChI=1S/C21H22N4O6/c1-25-15-7-6-14(19(28)24-9-8-17(26)27)10-16(15)31-21(20(25)29)30-11-12-2-4-13(5-3-12)18(22)23/h2-7,10,21H,8-9,11H2,1H3,(H3,22,23)(H,24,28)(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.12E+5	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
Prothrombin (Homo sapiens (Human))	BDBM50253779 (3-[2-(4-Carbamimidoylbenzyloxy)-4-methyl-3-oxo-3,4...) Show SMILES CN1C(=O)C(OCc2ccc(cc2)C(N)=N)Oc2cc(ccc12)C(=O)NCCC(O)=O Show InChI InChI=1S/C21H22N4O6/c1-25-15-7-6-14(19(28)24-9-8-17(26)27)10-16(15)31-21(20(25)29)30-11-12-2-4-13(5-3-12)18(22)23/h2-7,10,21H,8-9,11H2,1H3,(H3,22,23)(H,24,28)(H,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.18E+5	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
Integrin alpha-IIb (Homo sapiens (Human))	BDBM50253779 (3-[2-(4-Carbamimidoylbenzyloxy)-4-methyl-3-oxo-3,4...) Show SMILES CN1C(=O)C(OCc2ccc(cc2)C(N)=N)Oc2cc(ccc12)C(=O)NCCC(O)=O Show InChI InChI=1S/C21H22N4O6/c1-25-15-7-6-14(19(28)24-9-8-17(26)27)10-16(15)31-21(20(25)29)30-11-12-2-4-13(5-3-12)18(22)23/h2-7,10,21H,8-9,11H2,1H3,(H3,22,23)(H,24,28)(H,26,27)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.52E+4	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