BindingDB PrimarySearch

BDBM50196926 CHEMBL438139::Rocaglamide::US10085988, Compound (-) Roc-A

SMILES: COc1ccc(cc1)[C@@]12Oc3cc(OC)cc(OC)c3[C@]1(O)[C@H](O)[C@@H]([C@H]2c1ccccc1)C(=O)N(C)C

InChI Key: InChIKey=DAPAQENNNINUPW-IDAMAFBJSA-N

Data: 12 IC50 1 Kd 1 EC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50196926
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Transcription factor p65 (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of nuclear factor NF-kappa-B p65 subunit after 1 hr by ELISA				J Nat Prod 72: 2028-31 (2009) Article DOI: 10.1021/np900517h BindingDB Entry DOI: 10.7270/Q2R49QWK
The Ohio State University Curated by ChEMBL					More data for this Ligand-Target Pair
Nuclear factor NF-kappa-B p105 subunit (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of p50 after 1 hr by ELISA				J Nat Prod 72: 2028-31 (2009) Article DOI: 10.1021/np900517h BindingDB Entry DOI: 10.7270/Q2R49QWK
The Ohio State University Curated by ChEMBL					More data for this Ligand-Target Pair
Transcription factor p65 (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of NFkappa p65 in nuclear extract of human HeLa cells assessed as blockade of NFkappa p65 binding to biotinylated-consesus sequence by ELI...				J Nat Prod 74: 1117-25 (2011) Article DOI: 10.1021/np200051j BindingDB Entry DOI: 10.7270/Q20C4W31
The Ohio State University Curated by ChEMBL					More data for this Ligand-Target Pair
Transcription factor p65 (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Greensboro Curated by ChEMBL					Assay Description Inhibition of NFkappa p65 isolated from nuclear extract of human HeLa cells by ELISA				J Nat Prod 74: 1126-31 (2011) Article DOI: 10.1021/np200062x BindingDB Entry DOI: 10.7270/Q25M6621
					More data for this Ligand-Target Pair
Transcription factor p65 (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of NFkappa p65 isolated from nuclear extract of human HeLa cells assessed as blockade of binding to biotinylated consesus sequence by chem...				J Nat Prod 73: 949-55 (2010) Article DOI: 10.1021/np1002065 BindingDB Entry DOI: 10.7270/Q28S4QWW
The Ohio State University Curated by ChEMBL					More data for this Ligand-Target Pair
Nuclear factor NF-kappa-B p105 subunit (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of NFkappa p50 isolated from nuclear extract of human HeLa cells assessed as blockade of binding to biotinylated consesus sequence by chem...				J Nat Prod 73: 949-55 (2010) Article DOI: 10.1021/np1002065 BindingDB Entry DOI: 10.7270/Q28S4QWW
The Ohio State University Curated by ChEMBL					More data for this Ligand-Target Pair
Eukaryotic initiation factor 4A-I (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	231	n/a	n/a	n/a	n/a	n/a	n/a
Inception Therapeutics Curated by ChEMBL					Assay Description Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...				J Med Chem 63: 5879-5955 (2020)
Inception Therapeutics Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Transcription factor p65 (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Inhibition of biotinylated consensus sequence binding to NF-kB p65 in human HeLa nuclear extracts after 3 hrs by ELISA				Bioorg Med Chem 26: 4452-4460 (2018) Article DOI: 10.1016/j.bmc.2018.07.025 BindingDB Entry DOI: 10.7270/Q2N300MM
The Ohio State University Curated by ChEMBL					More data for this Ligand-Target Pair
Transcription factor p65 (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of TNF alpha stimulated NF-KappaB p65 in human HeLa nuclear extract assessed as decrease in NF-KappaB translocation to nucleus measured af...				J Nat Prod 82: 1645-1655 (2019) Article DOI: 10.1021/acs.jnatprod.9b00140
University of Illinois at Chicago Curated by ChEMBL					More data for this Ligand-Target Pair
Eukaryotic initiation factor 4A-I (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	n/a	156	n/a	n/a	n/a	n/a	n/a
Inception Therapeutics Curated by ChEMBL					Assay Description Binding affinity to full length recombinant eIF4A1 (unknown origin) assessed as induction ternary complex formation in presence of AGAGAG by measurin...				J Med Chem 63: 5879-5955 (2020)
Inception Therapeutics Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Eukaryotic initiation factor 4A-I (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	4.70	n/a	n/a	n/a	n/a	n/a	n/a
Inception Therapeutics Curated by ChEMBL					Assay Description Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...				J Med Chem 63: 5879-5955 (2020)
Inception Therapeutics Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Eukaryotic initiation factor 4A-I (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Inception Therapeutics Curated by ChEMBL					Assay Description Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...				J Med Chem 63: 5879-5955 (2020)
Inception Therapeutics Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Eukaryotic initiation factor 4A-I (Homo sapiens (Human))	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	135	n/a	n/a	n/a	n/a	n/a	n/a
Inception Therapeutics Curated by ChEMBL					Assay Description Inhibition of eIF4A1 in human MDA-MB-231 cells assessed as inhibition of cellular-translation incubated for 4 hrs by specific tandem sequence motif r...				J Med Chem 63: 5879-5955 (2020)
Inception Therapeutics Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Genome polyprotein (Hepatitis C virus genotype 2a (isolate HC-J6) (HCV...)	BDBM50196926 (CHEMBL438139 \| Rocaglamide \| US10085988, Compound ...) Show SMILES Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	US Patent	n/a	n/a	n/a	n/a	4	n/a	n/a	8.0	n/a
SRI International; Trustees of Boston University US Patent					Assay Description Huh7.5.1 cells from four 150 mm plates were treated with DMSO, Roc-A (20 nM), or infected by HCVcc. 48 h post-transfection, cells were washed three t...				US Patent US10085988 (2018) BindingDB Entry DOI: 10.7270/Q2WM1GFW
SRI International; Trustees of Boston University US Patent					More data for this Ligand-Target Pair