BDBM50067601 CHEMBL336748::N-[(R)-1-Formyl-2-(1H-indol-3-yl)-ethyl]-2-(naphthalene-1-sulfonylamino)-acetamide

SMILES: O=C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNS(=O)(=O)c1cccc2ccccc12

InChI Key: InChIKey=OUJSKEQQBPYQMY-GOSISDBHSA-N

Data: 2 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 2 hits for monomerid = 50067601   

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
Cathepsin B (Homo sapiens (Human))	BDBM50067601 (CHEMBL336748 | N-[(R)-1-Formyl-2-(1H-indol-3-yl)-e...) Show SMILES O=C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNS(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C23H21N3O4S/c27-15-18(12-17-13-24-21-10-4-3-8-19(17)21)26-23(28)14-25-31(29,30)22-11-5-7-16-6-1-2-9-20(16)22/h1-11,13,15,18,24-25H,12,14H2,(H,26,28)/t18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Chemical Industries, Ltd. Curated by ChEMBL					Assay Description Inhibition of human cathepsin B				J Med Chem 41: 4301-8 (1998) Article DOI: 10.1021/jm9803065 BindingDB Entry DOI: 10.7270/Q2VQ33CX
					More data for this Ligand-Target Pair
Procathepsin L (Homo sapiens (Human))	BDBM50067601 (CHEMBL336748 | N-[(R)-1-Formyl-2-(1H-indol-3-yl)-e...) Show SMILES O=C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CNS(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C23H21N3O4S/c27-15-18(12-17-13-24-21-10-4-3-8-19(17)21)26-23(28)14-25-31(29,30)22-11-5-7-16-6-1-2-9-20(16)22/h1-11,13,15,18,24-25H,12,14H2,(H,26,28)/t18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Chemical Industries, Ltd. Curated by ChEMBL					Assay Description Inhibition of human cathepsin L.				J Med Chem 41: 4301-8 (1998) Article DOI: 10.1021/jm9803065 BindingDB Entry DOI: 10.7270/Q2VQ33CX
					More data for this Ligand-Target Pair