BDBM50516214 CHEMBL4475733

SMILES: Cc1ccc(cc1)S(=O)(=O)N[C@@H](CC(=O)NC(C)(C)C)C(=O)NCCNC(=O)c1ccccn1

InChI Key: InChIKey=KPIBTNPKDISVCM-IBGZPJMESA-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 = 50516214   

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
26S proteosome (Homo sapiens (Human))	BDBM50516214 (CHEMBL4475733) Show SMILES Cc1ccc(cc1)S(=O)(=O)N[C@@H](CC(=O)NC(C)(C)C)C(=O)NCCNC(=O)c1ccccn1 |r| Show InChI InChI=1S/C23H31N5O5S/c1-16-8-10-17(11-9-16)34(32,33)28-19(15-20(29)27-23(2,3)4)22(31)26-14-13-25-21(30)18-7-5-6-12-24-18/h5-12,19,28H,13-15H2,1-4H3,(H,25,30)(H,26,31)(H,27,29)/t19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Medicine Curated by ChEMBL					Assay Description Inhibition of human beta5 20S immunoproteasome using Ac-ANW-AMC as substrate				J Med Chem 62: 6137-6145 (2019) Article DOI: 10.1021/acs.jmedchem.9b00363
					More data for this Ligand-Target Pair
Proteasome subunit beta type-1/beta type-5 (Homo sapiens (Human))	BDBM50516214 (CHEMBL4475733) Show SMILES Cc1ccc(cc1)S(=O)(=O)N[C@@H](CC(=O)NC(C)(C)C)C(=O)NCCNC(=O)c1ccccn1 |r| Show InChI InChI=1S/C23H31N5O5S/c1-16-8-10-17(11-9-16)34(32,33)28-19(15-20(29)27-23(2,3)4)22(31)26-14-13-25-21(30)18-7-5-6-12-24-18/h5-12,19,28H,13-15H2,1-4H3,(H,25,30)(H,26,31)(H,27,29)/t19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Medicine Curated by ChEMBL					Assay Description Inhibition of human beta5 20S constitutive proteasome using suc-LLVY-AMC as substrate				J Med Chem 62: 6137-6145 (2019) Article DOI: 10.1021/acs.jmedchem.9b00363
					More data for this Ligand-Target Pair