BDBM50411003 CHEMBL536973

SMILES: NCCCC[C@H](NC(=O)C1CCOC1)C(=O)c1noc(Cc2ccc(OCCc3ccc(Cl)c(Cl)c3)cc2)n1

InChI Key: InChIKey=NOWGVPLKMRUKNK-JWIMYKKASA-N

Data: 1 KI

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 = 50411003   

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
Tryptase (Homo sapiens (Human))	BDBM50411003 (CHEMBL536973) Show SMILES NCCCC[C@H](NC(=O)C1CCOC1)C(=O)c1noc(Cc2ccc(OCCc3ccc(Cl)c(Cl)c3)cc2)n1 |r| Show InChI InChI=1S/C28H32Cl2N4O5/c29-22-9-6-19(15-23(22)30)10-14-38-21-7-4-18(5-8-21)16-25-33-27(34-39-25)26(35)24(3-1-2-12-31)32-28(36)20-11-13-37-17-20/h4-9,15,20,24H,1-3,10-14,16-17,31H2,(H,32,36)/t20?,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Celera Genomics Curated by ChEMBL					Assay Description Inhibition of human B tryptase				Bioorg Med Chem Lett 16: 3434-9 (2006) Article DOI: 10.1016/j.bmcl.2006.04.013 BindingDB Entry DOI: 10.7270/Q2G44RHP
					More data for this Ligand-Target Pair