BDBM50242224 CHEMBL4070939

SMILES: CCCCCC[C@H]1[C@@H](OC1=O)C(=O)NCCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)OCc2ccccc2)C1=O

InChI Key: InChIKey=HQACOVOVAYEUBW-JKLQHZFJSA-N

Data: 4 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 4 hits for monomerid = 50242224   

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 Macropain subunit (Homo sapiens (Human))	BDBM50242224 (CHEMBL4070939) Show SMILES CCCCCC[C@H]1[C@@H](OC1=O)C(=O)NCCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)OCc2ccccc2)C1=O |r| Show InChI InChI=1S/C27H37N3O7/c1-3-4-5-9-14-20-22(37-26(20)34)23(31)28-16-11-10-15-21-24(32)30(27(35)29-21)18(2)25(33)36-17-19-12-7-6-8-13-19/h6-8,12-13,18,20-22H,3-5,9-11,14-17H2,1-2H3,(H,28,31)(H,29,35)/t18-,20-,21-,22+/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	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Baylor University Curated by ChEMBL					Assay Description Inhibition of trypsin-like activity of 20S proteasome in human red blood cells pretreated for 20 mins followed by Boc-Leu-Arg-Arg-AMC substrate addit...				Bioorg Med Chem 25: 2901-2916 (2017) Article DOI: 10.1016/j.bmc.2017.01.020 BindingDB Entry DOI: 10.7270/Q26W9DG3
					More data for this Ligand-Target Pair
Proteasome subunit beta type-1/beta type-5 (Homo sapiens (Human))	BDBM50242224 (CHEMBL4070939) Show SMILES CCCCCC[C@H]1[C@@H](OC1=O)C(=O)NCCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)OCc2ccccc2)C1=O |r| Show InChI InChI=1S/C27H37N3O7/c1-3-4-5-9-14-20-22(37-26(20)34)23(31)28-16-11-10-15-21-24(32)30(27(35)29-21)18(2)25(33)36-17-19-12-7-6-8-13-19/h6-8,12-13,18,20-22H,3-5,9-11,14-17H2,1-2H3,(H,28,31)(H,29,35)/t18-,20-,21-,22+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Baylor University Curated by ChEMBL					Assay Description Inhibition of chymotrypsin-like activity of 20S proteasome in human red blood cells pretreated for 20 mins followed by Suc-Leu-Leu-Val-Tyr-AMC substr...				Bioorg Med Chem 25: 2901-2916 (2017) Article DOI: 10.1016/j.bmc.2017.01.020 BindingDB Entry DOI: 10.7270/Q26W9DG3
					More data for this Ligand-Target Pair
Proteasome component C5 (Homo sapiens (Human))	BDBM50242224 (CHEMBL4070939) Show SMILES CCCCCC[C@H]1[C@@H](OC1=O)C(=O)NCCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)OCc2ccccc2)C1=O |r| Show InChI InChI=1S/C27H37N3O7/c1-3-4-5-9-14-20-22(37-26(20)34)23(31)28-16-11-10-15-21-24(32)30(27(35)29-21)18(2)25(33)36-17-19-12-7-6-8-13-19/h6-8,12-13,18,20-22H,3-5,9-11,14-17H2,1-2H3,(H,28,31)(H,29,35)/t18-,20-,21-,22+/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	7.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
Baylor University Curated by ChEMBL					Assay Description Inhibition of caspase-like activity of 20S proteasome in human red blood cells pretreated for 20 mins followed by Z-Leu-Leu-Glu-AMC substrate additio...				Bioorg Med Chem 25: 2901-2916 (2017) Article DOI: 10.1016/j.bmc.2017.01.020 BindingDB Entry DOI: 10.7270/Q26W9DG3
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM50242224 (CHEMBL4070939) Show SMILES CCCCCC[C@H]1[C@@H](OC1=O)C(=O)NCCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)OCc2ccccc2)C1=O |r| Show InChI InChI=1S/C27H37N3O7/c1-3-4-5-9-14-20-22(37-26(20)34)23(31)28-16-11-10-15-21-24(32)30(27(35)29-21)18(2)25(33)36-17-19-12-7-6-8-13-19/h6-8,12-13,18,20-22H,3-5,9-11,14-17H2,1-2H3,(H,28,31)(H,29,35)/t18-,20-,21-,22+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
Baylor University Curated by ChEMBL					Assay Description Inhibition of human FAS thioster domain preincubated for 30 mins followed by 4-methylumbelliferyl heptanoate substrate addition measured every 5 mins...				Bioorg Med Chem 25: 2901-2916 (2017) Article DOI: 10.1016/j.bmc.2017.01.020 BindingDB Entry DOI: 10.7270/Q26W9DG3
					More data for this Ligand-Target Pair