BDBM50293404 (S)-N-((6-amino-2-methylpyridin-3-yl)methyl)-3-(4-oxo-3-(phenylmethylsulfonamido)-3,4-dihydrobenzo[b][1,4]thiazepin-5(2H)-yl)propanamide, trifluoroacetate::CHEMBL553179

SMILES: Cc1nc(N)ccc1CNC(=O)CCN1c2ccccc2SC[C@@H](NS(=O)(=O)Cc2ccccc2)C1=O

InChI Key: InChIKey=XWGOBXUFLRQJGC-OAQYLSRUSA-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 = 50293404   

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 VII/tissue factor (Homo sapiens (Human))	BDBM50293404 ((S)-N-((6-amino-2-methylpyridin-3-yl)methyl)-3-(4-...) Show SMILES Cc1nc(N)ccc1CNC(=O)CCN1c2ccccc2SC[C@@H](NS(=O)(=O)Cc2ccccc2)C1=O |r| Show InChI InChI=1S/C26H29N5O4S2/c1-18-20(11-12-24(27)29-18)15-28-25(32)13-14-31-22-9-5-6-10-23(22)36-16-21(26(31)33)30-37(34,35)17-19-7-3-2-4-8-19/h2-12,21,30H,13-17H2,1H3,(H2,27,29)(H,28,32)/t21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Montpellier 1 Curated by ChEMBL					Assay Description Inhibition of human tissue factor/factor 7a				Bioorg Med Chem Lett 19: 1386-91 (2009) Article DOI: 10.1016/j.bmcl.2009.01.039 BindingDB Entry DOI: 10.7270/Q2G73DRB
					More data for this Ligand-Target Pair