BDBM50031694 CHEMBL3360293

SMILES: CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)C(=O)N[C@@H](C)C(=O)N1CCN(C)CC1

InChI Key: InChIKey=BNUWHUVPEYIVAB-ZCUSHOGSSA-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 = 50031694   

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))	BDBM50031694 (CHEMBL3360293) Show SMILES CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)C(=O)N[C@@H](C)C(=O)N1CCN(C)CC1 |r| Show InChI InChI=1S/C33H44N6O6/c1-21(2)27(28(40)32(44)35-23(4)33(45)39-18-16-38(5)17-19-39)37-29(41)22(3)34-31(43)26(20-24-12-8-6-9-13-24)36-30(42)25-14-10-7-11-15-25/h6-15,21-23,26-27H,16-20H2,1-5H3,(H,34,43)(H,35,44)(H,36,42)(H,37,41)/t22-,23-,26-,27-/m0/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	>2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Domainex Ltd. Curated by ChEMBL					Assay Description Inhibition of human liver cathepsin B using ABz-Gly-Ile-Val-Arg-Ala-Lys-DNP-OH as substrate after 10 mins by fluorescence assay				J Med Chem 57: 9447-62 (2014) Article DOI: 10.1021/jm501102h BindingDB Entry DOI: 10.7270/Q2R212ZW
					More data for this Ligand-Target Pair
Peptidase 1 (Der p 1) (Dermatophagoides pteronyssinus (European house dus...)	BDBM50031694 (CHEMBL3360293) Show SMILES CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)C(=O)N[C@@H](C)C(=O)N1CCN(C)CC1 |r| Show InChI InChI=1S/C33H44N6O6/c1-21(2)27(28(40)32(44)35-23(4)33(45)39-18-16-38(5)17-19-39)37-29(41)22(3)34-31(43)26(20-24-12-8-6-9-13-24)36-30(42)25-14-10-7-11-15-25/h6-15,21-23,26-27H,16-20H2,1-5H3,(H,34,43)(H,35,44)(H,36,42)(H,37,41)/t22-,23-,26-,27-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Domainex Ltd. Curated by ChEMBL					Assay Description Inhibition of house dust mite Derp-1 after 20 mins				J Med Chem 57: 9447-62 (2014) Article DOI: 10.1021/jm501102h BindingDB Entry DOI: 10.7270/Q2R212ZW
					More data for this Ligand-Target Pair