BDBM50293406 (S)-N-(5-(2-(4-carbamimidoylbenzylamino)-2-oxoethyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl)-2,2-diphenylacetamide, trifluoroacetate::CHEMBL564750

SMILES: NC(=N)c1ccc(CNC(=O)CN2c3ccccc3SC[C@@H](NC(=O)C(c3ccccc3)c3ccccc3)C2=O)cc1

InChI Key: InChIKey=XXCVQTMDWIPPNH-AREMUKBSSA-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 = 50293406   

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))	BDBM50293406 ((S)-N-(5-(2-(4-carbamimidoylbenzylamino)-2-oxoethy...) Show SMILES NC(=N)c1ccc(CNC(=O)CN2c3ccccc3SC[C@@H](NC(=O)C(c3ccccc3)c3ccccc3)C2=O)cc1 |r| Show InChI InChI=1S/C33H31N5O3S/c34-31(35)25-17-15-22(16-18-25)19-36-29(39)20-38-27-13-7-8-14-28(27)42-21-26(33(38)41)37-32(40)30(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-18,26,30H,19-21H2,(H3,34,35)(H,36,39)(H,37,40)/t26-/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