BDBM50119293 CHEMBL3613813

SMILES: COC(=O)[C@@H](NC(=O)N[C@@H](C(C)C)C(=O)N[C@H]1CCCCNC(=O)\C=C\[C@H](CC(C)C)NC1=O)C(C)C

InChI Key: InChIKey=KSTMADKITGLTFU-JITZIFCZSA-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 = 50119293   

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
20S proteasome chymotrypsin-like (Homo sapiens (Human))	BDBM50119293 (CHEMBL3613813) Show SMILES COC(=O)[C@@H](NC(=O)N[C@@H](C(C)C)C(=O)N[C@H]1CCCCNC(=O)\C=C\[C@H](CC(C)C)NC1=O)C(C)C |r,t:24| Show InChI InChI=1S/C26H45N5O6/c1-15(2)14-18-11-12-20(32)27-13-9-8-10-19(23(33)28-18)29-24(34)21(16(3)4)30-26(36)31-22(17(5)6)25(35)37-7/h11-12,15-19,21-22H,8-10,13-14H2,1-7H3,(H,27,32)(H,28,33)(H,29,34)(H2,30,31,36)/b12-11+/t18-,19+,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.23E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Brown University Curated by ChEMBL					Assay Description Inhibition of human 20S proteasome beta5 subunit using Suc-LLVY-AMC as substrate by fluorescence assay				Bioorg Med Chem 23: 6218-22 (2015) BindingDB Entry DOI: 10.7270/Q25B0499
					More data for this Ligand-Target Pair