BDBM50538181 CHEMBL4642756

SMILES: CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)c1cnc(C)s1)C(=O)[C@@]1(C)CO1

InChI Key: InChIKey=SADWHDOUMIGRMY-ILSPQUDCSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50538181   

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
Proteasome subunit beta type-9 (Homo sapiens (Human))	BDBM50538181 (CHEMBL4642756) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)c1cnc(C)s1)C(=O)[C@@]1(C)CO1 |r| Show InChI InChI=1S/C31H41N5O6S/c1-19(2)15-23(27(38)31(4)18-42-31)35-28(39)22(13-12-21-9-6-5-7-10-21)34-29(40)24-11-8-14-36(24)26(37)17-33-30(41)25-16-32-20(3)43-25/h5-7,9-10,16,19,22-24H,8,11-15,17-18H2,1-4H3,(H,33,41)(H,34,40)(H,35,39)/t22-,23-,24-,31+/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Inhibition of LMP2 in human 20S immunoproteasome using Ac-PAL-AMC as substrate after 1 hr by fluorescence based microplate reader analysis				J Med Chem 63: 3763-3783 (2020)
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