BDBM50032890 CHEMBL3342780

SMILES: CS(=O)(=O)c1cc(ccc1C1N(C(=O)N2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)F)C#N

InChI Key: InChIKey=NJYDZYZDBMOWCU-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 50032890   

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))	BDBM50032890 (CHEMBL3342780) Show SMILES CS(=O)(=O)c1cc(ccc1C1N(C(=O)N2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)F)C#N |c:22| Show InChI InChI=1S/C25H20F2N4O5S/c1-37(35,36)20-11-14(13-28)5-6-17(20)22-21-18(7-8-19(21)32)30(16-4-2-3-15(12-16)23(26)27)25(34)31(22)24(33)29-9-10-29/h2-6,11-12,22-23H,7-10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	<1	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of neutrophil elastase in human plasma using MeOSuc-Ala-Ala-Pro-Val-AMC as substrate by fluorescence assay				ACS Med Chem Lett 5: 1182-3 (2014) Article DOI: 10.1021/ml500346u BindingDB Entry DOI: 10.7270/Q2N29ZJC
					More data for this Ligand-Target Pair
Leukocyte elastase (Homo sapiens (Human))	BDBM50032890 (CHEMBL3342780) Show SMILES CS(=O)(=O)c1cc(ccc1C1N(C(=O)N2CC2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)F)C#N |c:22| Show InChI InChI=1S/C25H20F2N4O5S/c1-37(35,36)20-11-14(13-28)5-6-17(20)22-21-18(7-8-19(21)32)30(16-4-2-3-15(12-16)23(26)27)25(34)31(22)24(33)29-9-10-29/h2-6,11-12,22-23H,7-10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of human neutrophil elastase using MeOSuc-Ala-Ala-Pro-Val-AMC as substrate after 15 mins by fluorescence assay				ACS Med Chem Lett 5: 1182-3 (2014) Article DOI: 10.1021/ml500346u BindingDB Entry DOI: 10.7270/Q2N29ZJC
					More data for this Ligand-Target Pair