BDBM50516230 CHEMBL4532885

SMILES: Cc1ccc(cc1)S(=O)(=O)N[C@@H](CC(=O)NC(C)(C)C)C(=O)NCCNC(=O)c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=LBLXDCWWFWJQAC-FQEVSTJZSA-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 = 50516230   

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-1/beta type-5 (Homo sapiens (Human))	BDBM50516230 (CHEMBL4532885) Show SMILES Cc1ccc(cc1)S(=O)(=O)N[C@@H](CC(=O)NC(C)(C)C)C(=O)NCCNC(=O)c1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C25H31F3N4O5S/c1-16-8-10-19(11-9-16)38(36,37)32-20(15-21(33)31-24(2,3)4)23(35)30-13-12-29-22(34)17-6-5-7-18(14-17)25(26,27)28/h5-11,14,20,32H,12-13,15H2,1-4H3,(H,29,34)(H,30,35)(H,31,33)/t20-/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	3.71E+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
26S proteosome (Homo sapiens (Human))	BDBM50516230 (CHEMBL4532885) Show SMILES Cc1ccc(cc1)S(=O)(=O)N[C@@H](CC(=O)NC(C)(C)C)C(=O)NCCNC(=O)c1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C25H31F3N4O5S/c1-16-8-10-19(11-9-16)38(36,37)32-20(15-21(33)31-24(2,3)4)23(35)30-13-12-29-22(34)17-6-5-7-18(14-17)25(26,27)28/h5-11,14,20,32H,12-13,15H2,1-4H3,(H,29,34)(H,30,35)(H,31,33)/t20-/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	763	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