BindingDB PrimarySearch

BDBM50315537 CHEMBL1089316::chaetocin

SMILES: CN1C(=O)[C@@]23C[C@]4([C@H](Nc5ccccc45)N2C(=O)[C@]1(CO)SS3)[C@]12C[C@]34SS[C@](CO)(N(C)C3=O)C(=O)N4[C@H]1Nc1ccccc21

InChI Key: InChIKey=PZPPOCZWRGNKIR-PNVYSBBASA-N

Data: 27 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 27 hits for monomerid = 50315537
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
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Icahn School of Medicine at Mount Sinai Curated by ChEMBL					Assay Description Inhibition of G9a (unknown origin) using SAM/biotinylated H3 as substrate preincubated for 1 hr followed by substrate addition measured after 2 hrs b...				J Med Chem 58: 1596-629 (2015) Article DOI: 10.1021/jm501234a BindingDB Entry DOI: 10.7270/Q28K7BS2
Icahn School of Medicine at Mount Sinai Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT1/EHMT2 (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Punjabi University Curated by ChEMBL					Assay Description Inhibition of GST-tagged EHMT2 (unknown origin) using biotinylated-H3 peptide as substrate preincubated for 1 hr followed by substrate addition and m...				Eur J Med Chem 166: 351-368 (2019) Article DOI: 10.1016/j.ejmech.2019.01.069
Punjabi University Curated by ChEMBL					More data for this Ligand-Target Pair
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of GST-tagged G9a after 1 hr by radioactive filter-binding assay				Eur J Med Chem 56: 179-194 (2012) Article DOI: 10.1016/j.ejmech.2012.08.010 BindingDB Entry DOI: 10.7270/Q2TQ62NX
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase pr-set7 (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster PRSET7				Eur J Med Chem 56: 179-194 (2012) Article DOI: 10.1016/j.ejmech.2012.08.010 BindingDB Entry DOI: 10.7270/Q2TQ62NX
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase E(z) (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster E(Z)				Eur J Med Chem 56: 179-194 (2012) Article DOI: 10.1016/j.ejmech.2012.08.010 BindingDB Entry DOI: 10.7270/Q2TQ62NX
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2 (Mus musculus)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of mouse G9a				Eur J Med Chem 56: 179-194 (2012) Article DOI: 10.1016/j.ejmech.2012.08.010 BindingDB Entry DOI: 10.7270/Q2TQ62NX
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase SUV39H1 (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human SUV39H1				Eur J Med Chem 56: 179-194 (2012) Article DOI: 10.1016/j.ejmech.2012.08.010 BindingDB Entry DOI: 10.7270/Q2TQ62NX
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase Su(var)3-9 (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of recombinant Drosophila melanogaster SUV39 by radioactive filter-binding assay				Eur J Med Chem 56: 179-194 (2012) Article DOI: 10.1016/j.ejmech.2012.08.010 BindingDB Entry DOI: 10.7270/Q2TQ62NX
TBA Curated by ChEMBL					More data for this Ligand-Target Pair
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of N-terminal GST-tagged recombinant human Histone-lysine N-methyltransferase G9a using S-(5'-adenosyl)-L-methionine chloride as substrate...				J Med Chem 56: 8616-25 (2013) Article DOI: 10.1021/jm401063r BindingDB Entry DOI: 10.7270/Q2NS0WDK
Imperial College London Curated by ChEMBL					More data for this Ligand-Target Pair
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of N-terminal GST-tagged recombinant human Histone-lysine N-methyltransferase G9a using S-(5'-adenosyl)-L-methionine chloride as substrate...				J Med Chem 56: 8616-25 (2013) Article DOI: 10.1021/jm401063r BindingDB Entry DOI: 10.7270/Q2NS0WDK
Imperial College London Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2 (Mus musculus)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of mouse Histone-lysine N-methyltransferase G9a				J Med Chem 56: 8616-25 (2013) Article DOI: 10.1021/jm401063r BindingDB Entry DOI: 10.7270/Q2NS0WDK
Imperial College London Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase SUV39H1 (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of human Histone-lysine N-methyltransferase SUV39H1				J Med Chem 56: 8616-25 (2013) Article DOI: 10.1021/jm401063r BindingDB Entry DOI: 10.7270/Q2NS0WDK
Imperial College London Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase Su(var)3-9 (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Imperial College London Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster Histone-lysine N-methyltransferase Su(var)3-9				J Med Chem 56: 8616-25 (2013) Article DOI: 10.1021/jm401063r BindingDB Entry DOI: 10.7270/Q2NS0WDK
Imperial College London Curated by ChEMBL					More data for this Ligand-Target Pair
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
RIKEN Advanced Science Institute Curated by ChEMBL					Assay Description Inhibition of protein lysine methyltransferase G9a (unknown origin) by ELISA assay				Bioorg Med Chem Lett 23: 733-6 (2013) Article DOI: 10.1016/j.bmcl.2012.11.087 BindingDB Entry DOI: 10.7270/Q22V2HFN
RIKEN Advanced Science Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
RIKEN Advanced Science Institute Curated by ChEMBL					Assay Description Inhibition of protein lysine methyltransferase G9a (unknown origin) by modified ELISA assay				Bioorg Med Chem Lett 23: 733-6 (2013) Article DOI: 10.1016/j.bmcl.2012.11.087 BindingDB Entry DOI: 10.7270/Q22V2HFN
RIKEN Advanced Science Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Dongguk University-Seoul Curated by ChEMBL					Assay Description Inhibition of HIF-1alpha-mediated VEGF secretion in human Hep3b cells by ELISA				Eur J Med Chem 49: 24-40 (2012) Article DOI: 10.1016/j.ejmech.2012.01.033 BindingDB Entry DOI: 10.7270/Q26D5V4N
Dongguk University-Seoul Curated by ChEMBL					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Dongguk University-Seoul Curated by ChEMBL					Assay Description Inhibition of HIF-1alpha-mediated VEGF expression in human Hep3b cells by luciferase reporter gene assay				Eur J Med Chem 49: 24-40 (2012) Article DOI: 10.1016/j.ejmech.2012.01.033 BindingDB Entry DOI: 10.7270/Q26D5V4N
Dongguk University-Seoul Curated by ChEMBL					More data for this Ligand-Target Pair
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Dongguk University-Seoul Curated by ChEMBL					Assay Description Inhibition of HIF-1alpha transcriptional co-activator p300 interaction				Eur J Med Chem 49: 24-40 (2012) Article DOI: 10.1016/j.ejmech.2012.01.033 BindingDB Entry DOI: 10.7270/Q26D5V4N
Dongguk University-Seoul Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase, H3 lysine-9 specific dim-5 (Neurospora crassa)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ludwig-Maximillians University of Munich Curated by ChEMBL					Assay Description Inhibition of Neurospora crassa DIM5				Nat Chem Biol 1: 143-5 (2005) Article DOI: 10.1038/nchembio721 BindingDB Entry DOI: 10.7270/Q2PK0JZV
Ludwig-Maximillians University of Munich Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase E(z) (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Ludwig-Maximillians University of Munich Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster histone-lysine N-methyl-transferase E(z)				Nat Chem Biol 1: 143-5 (2005) Article DOI: 10.1038/nchembio721 BindingDB Entry DOI: 10.7270/Q2PK0JZV
Ludwig-Maximillians University of Munich Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase Su(var)3-9 (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Ludwig-Maximillians University of Munich Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster SU(VAR)3-9				Nat Chem Biol 1: 143-5 (2005) Article DOI: 10.1038/nchembio721 BindingDB Entry DOI: 10.7270/Q2PK0JZV
Ludwig-Maximillians University of Munich Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT2 (Mus musculus)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ludwig-Maximillians University of Munich Curated by ChEMBL					Assay Description Inhibition of mouse G9a				Nat Chem Biol 1: 143-5 (2005) Article DOI: 10.1038/nchembio721 BindingDB Entry DOI: 10.7270/Q2PK0JZV
Ludwig-Maximillians University of Munich Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase pr-set7 (Drosophila melanogaster)	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
Ludwig-Maximillians University of Munich Curated by ChEMBL					Assay Description Inhibition of Drosophila melanogaster PRSET2				Nat Chem Biol 1: 143-5 (2005) Article DOI: 10.1038/nchembio721 BindingDB Entry DOI: 10.7270/Q2PK0JZV
Ludwig-Maximillians University of Munich Curated by ChEMBL					More data for this Ligand-Target Pair
Histone acetyltransferase p300/Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of N-terminal biotinylated HIF-1alpha (786 to 826 residues) (unknown origin)/GST-tagged p300-CH1 domain (unknown origin) protein-protein i...				J Med Chem 62: 5725-5749 (2019) Article DOI: 10.1021/acs.jmedchem.8b01596
China Pharmaceutical University Curated by ChEMBL					More data for this Ligand-Target Pair
Histone acetyltransferase p300/Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of HIF-1alpha (unknown origin)/p300 (unknown origin) protein-protein interaction				Bioorg Med Chem 27: 1145-1158 (2019) Article DOI: 10.1016/j.bmc.2019.01.042
China Pharmaceutical University Curated by ChEMBL					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EHMT1/EHMT2 (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Southern Medical University Curated by ChEMBL					Assay Description Inhibition human G9a catalytic domain				Eur J Med Chem 179: 537-546 (2019) Article DOI: 10.1016/j.ejmech.2019.06.072
Southern Medical University Curated by ChEMBL					More data for this Ligand-Target Pair
Thioredoxin reductase 1 (TrxR) (Homo sapiens (Human))	BDBM50315537 (CHEMBL1089316 \| chaetocin) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Santa Cruz Curated by ChEMBL					Assay Description Inhibition of thioredoxin reductase 1				Bioorg Med Chem 18: 2566-74 (2010) Article DOI: 10.1016/j.bmc.2010.02.034 BindingDB Entry DOI: 10.7270/Q22J6C0K
University of California Santa Cruz Curated by ChEMBL					More data for this Ligand-Target Pair