BDBM50114462 2-(3-Carbamimidoyl-phenoxy)-4-methylamino-N-(2'-sulfamoyl-biphenyl-4-yl)-benzamide::CHEMBL48131

SMILES: CNc1ccc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c(Oc2cccc(c2)C(N)=N)c1

InChI Key: InChIKey=NAXYVUMUHCNTFD-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 = 50114462   

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))	BDBM50114462 (2-(3-Carbamimidoyl-phenoxy)-4-methylamino-N-(2'-su...) Show SMILES CNc1ccc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c(Oc2cccc(c2)C(N)=N)c1 Show InChI InChI=1S/C27H25N5O4S/c1-31-20-13-14-23(24(16-20)36-21-6-4-5-18(15-21)26(28)29)27(33)32-19-11-9-17(10-12-19)22-7-2-3-8-25(22)37(30,34)35/h2-16,31H,1H3,(H3,28,29)(H,32,33)(H2,30,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	12	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