BDBM50217312 CHEMBL324918

SMILES: N=C(NCc1ccccc1)c1ccc2oc(cc2c1)C(=O)N1CCN(CC1)C(=O)COc1ccc(OCC(=O)N2CCN(CC2)C(=O)c2cc3cc(ccc3o2)C(=N)NCc2ccccc2)cc1

InChI Key: InChIKey=WAZLFBJGPHXRMN-UHFFFAOYSA-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 = 50217312   

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))	BDBM50217312 (CHEMBL324918) Show SMILES N=C(NCc1ccccc1)c1ccc2oc(cc2c1)C(=O)N1CCN(CC1)C(=O)COc1ccc(OCC(=O)N2CCN(CC2)C(=O)c2cc3cc(ccc3o2)C(=N)NCc2ccccc2)cc1 Show InChI InChI=1S/C52H50N8O8/c53-49(55-31-35-7-3-1-4-8-35)37-11-17-43-39(27-37)29-45(67-43)51(63)59-23-19-57(20-24-59)47(61)33-65-41-13-15-42(16-14-41)66-34-48(62)58-21-25-60(26-22-58)52(64)46-30-40-28-38(12-18-44(40)68-46)50(54)56-32-36-9-5-2-6-10-36/h1-18,27-30H,19-26,31-34H2,(H2,53,55)(H2,54,56)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yoshitomi Pharmaceutical Industries, LTD. Curated by ChEMBL					Assay Description Inhibition of tryptase activity				Bioorg Med Chem Lett 9: 3285-90 (2000) BindingDB Entry DOI: 10.7270/Q2TX3DK3
					More data for this Ligand-Target Pair