BDBM50291949 (4S,7S)-2-Benzoyl-7-methoxy-4-(1-methyl-1H-tetrazol-5-ylsulfanyl)-3-(1-methyl-1H-tetrazol-5-ylsulfanylmethyl)-5,5-dioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-en-8-one::CHEMBL131475

SMILES: CO[C@@H]1C2N(C1=O)C(C(=O)c1ccccc1)=C(CSc1nnnn1C)[C@@H](Sc1nnnn1C)S2(=O)=O

InChI Key: InChIKey=FRKBCTPLDZIVTP-NZEUDUFCSA-N

Data: 1 K_on

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 = 50291949   

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
Leukocyte elastase (Homo sapiens (Human))	BDBM50291949 ((4S,7S)-2-Benzoyl-7-methoxy-4-(1-methyl-1H-tetrazo...) Show SMILES CO[C@@H]1C2N(C1=O)C(C(=O)c1ccccc1)=C(CSc1nnnn1C)[C@@H](Sc1nnnn1C)S2(=O)=O |t:17| Show InChI InChI=1S/C19H19N9O5S3/c1-26-18(20-22-24-26)34-9-11-12(13(29)10-7-5-4-6-8-10)28-15(30)14(33-3)16(28)36(31,32)17(11)35-19-21-23-25-27(19)2/h4-8,14,16-17H,9H2,1-3H3/t14-,16?,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	n/a	n/a	2.20	n/a	n/a
Pharmacia Farmitalia Carlo Erba Curated by ChEMBL					Assay Description Tested for the rate constant against Human Leukocyte Elastase (HLE) inactivation				J Med Chem 37: 4003-19 (1994) BindingDB Entry DOI: 10.7270/Q2T43S5B
					More data for this Ligand-Target Pair