BDBM415709 Ac-LDEETGEFL-OH::US10442759, Compound Nrf2 9mer Peptide
SMILES: CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(O)=O
InChI Key: InChIKey=GAFLTUQDNVDCCP-PRDVVYQQSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
KEAP1/Cullin-3/Microtubule-associated protein tau (Homo sapiens (Human)) | BDBM415709 (Ac-LDEETGEFL-OH | US10442759, Compound Nrf2 9mer ...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 50 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen Curated by ChEMBL | Assay Description Inhibition of recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3)pLysS cells by fluorescence polariza... | J Med Chem 62: 8028-8052 (2019) Article DOI: 10.1021/acs.jmedchem.9b00723 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
KEAP1/Cullin-3/Microtubule-associated protein tau (Homo sapiens (Human)) | BDBM415709 (Ac-LDEETGEFL-OH | US10442759, Compound Nrf2 9mer ...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 51 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen Curated by ChEMBL | Assay Description Inhibition of Cys5-LDEETGEFL-NH2 binding to recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3) measu... | J Med Chem 62: 8028-8052 (2019) Article DOI: 10.1021/acs.jmedchem.9b00723 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
KEAP1/Cullin-3/Microtubule-associated protein tau (Homo sapiens (Human)) | BDBM415709 (Ac-LDEETGEFL-OH | US10442759, Compound Nrf2 9mer ...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen Curated by ChEMBL | Assay Description Binding affinity to recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3) by surface plasmon resonance ... | J Med Chem 62: 8028-8052 (2019) Article DOI: 10.1021/acs.jmedchem.9b00723 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nrf2-Keap1 protein (Homo sapiens (Human)) | BDBM415709 (Ac-LDEETGEFL-OH | US10442759, Compound Nrf2 9mer ...) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
CHINA PHARMACEUTICAL UNIVERSITY US Patent | Assay Description The instrument used in the FP experiment was the SpectraMax Multi-Mode Microplate Reader (Molecular Devices), and the excitation and emission wavelen... | US Patent US10442759 (2019) BindingDB Entry DOI: 10.7270/Q25D8V7T | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
KEAP1/Cullin-3/Microtubule-associated protein tau (Homo sapiens (Human)) | BDBM415709 (Ac-LDEETGEFL-OH | US10442759, Compound Nrf2 9mer ...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a |
University of Copenhagen Curated by ChEMBL | Assay Description Binding affinity to recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3) assessed as thermal stabiliza... | J Med Chem 62: 8028-8052 (2019) Article DOI: 10.1021/acs.jmedchem.9b00723 | |||||||||||
More data for this Ligand-Target Pair |