BDBM50293403 (S)-2-(5-(2-((6-amino-2-methylpyridin-3-yl)methylamino)-2-oxoethyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-ylamino)acetic acid.2,2,2-trifluoroacetic acid::CHEMBL563607

SMILES: Cc1nc(N)ccc1CNC(=O)CN1c2ccccc2SC[C@@H](NCC(O)=O)C1=O

InChI Key: InChIKey=IOYZZUGWJHFZKM-CQSZACIVSA-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 = 50293403   

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))	BDBM50293403 ((S)-2-(5-(2-((6-amino-2-methylpyridin-3-yl)methyla...) Show SMILES Cc1nc(N)ccc1CNC(=O)CN1c2ccccc2SC[C@@H](NCC(O)=O)C1=O |r| Show InChI InChI=1S/C20H23N5O4S/c1-12-13(6-7-17(21)24-12)8-23-18(26)10-25-15-4-2-3-5-16(15)30-11-14(20(25)29)22-9-19(27)28/h2-7,14,22H,8-11H2,1H3,(H2,21,24)(H,23,26)(H,27,28)/t14-/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