BDBM50114499 4-Acetylamino-2-(3-carbamimidoyl-phenoxy)-N-(2'-sulfamoyl-biphenyl-4-yl)-benzamide::CHEMBL45888

SMILES: CC(=O)Nc1ccc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c(Oc2cccc(c2)C(N)=N)c1

InChI Key: InChIKey=ZDKALETWIJKRDC-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50114499   

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))	BDBM50114499 (4-Acetylamino-2-(3-carbamimidoyl-phenoxy)-N-(2'-su...) Show SMILES CC(=O)Nc1ccc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c(Oc2cccc(c2)C(N)=N)c1 Show InChI InChI=1S/C28H25N5O5S/c1-17(34)32-21-13-14-24(25(16-21)38-22-6-4-5-19(15-22)27(29)30)28(35)33-20-11-9-18(10-12-20)23-7-2-3-8-26(23)39(31,36)37/h2-16H,1H3,(H3,29,30)(H,32,34)(H,33,35)(H2,31,36,37)	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Tested in vitro for the inhibitory activity against Coagulation factor Xa				Bioorg Med Chem Lett 12: 1657-61 (2002) BindingDB Entry DOI: 10.7270/Q2R49Q2T
					More data for this Ligand-Target Pair