BDBM50232350 CHEMBL4062520

SMILES: CN1CCc2c(C1)c1ccccc1n2S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1

InChI Key: InChIKey=AKVIPQCFHGRAMC-MDZDMXLPSA-N

Data: 3 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 3 hits for monomerid = 50232350   

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
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50232350 (CHEMBL4062520) Show SMILES CN1CCc2c(C1)c1ccccc1n2S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1 Show InChI InChI=1S/C21H21N3O4S/c1-23-12-11-20-18(14-23)17-7-2-3-8-19(17)24(20)29(27,28)16-6-4-5-15(13-16)9-10-21(25)22-26/h2-10,13,26H,11-12,14H2,1H3,(H,22,25)/b10-9+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of full length human recombinant C-terminal FLAG-His-tagged HDAC1 expressed in Sf21 cells using RHKK(Ac) as substrate after 60 mins by flu...				Eur J Med Chem 127: 115-127 (2017) BindingDB Entry DOI: 10.7270/Q20K2BT4
					More data for this Ligand-Target Pair
Cereblon/Histone deacetylase 6 (Homo sapiens (Human))	BDBM50232350 (CHEMBL4062520) Show SMILES CN1CCc2c(C1)c1ccccc1n2S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1 Show InChI InChI=1S/C21H21N3O4S/c1-23-12-11-20-18(14-23)17-7-2-3-8-19(17)24(20)29(27,28)16-6-4-5-15(13-16)9-10-21(25)22-26/h2-10,13,26H,11-12,14H2,1H3,(H,22,25)/b10-9+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of full length human recombinant N-terminal GST-tagged HDAC6 expressed in Sf9 cells using RHKK(Ac) as substrate after 90 mins by fluorimet...				Eur J Med Chem 127: 115-127 (2017) BindingDB Entry DOI: 10.7270/Q20K2BT4
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50232350 (CHEMBL4062520) Show SMILES CN1CCc2c(C1)c1ccccc1n2S(=O)(=O)c1cccc(\C=C\C(=O)NO)c1 Show InChI InChI=1S/C21H21N3O4S/c1-23-12-11-20-18(14-23)17-7-2-3-8-19(17)24(20)29(27,28)16-6-4-5-15(13-16)9-10-21(25)22-26/h2-10,13,26H,11-12,14H2,1H3,(H,22,25)/b10-9+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of full length human recombinant C-terminal GST-tagged HDAC2 expressed in insect cells using RHKK(Ac) as substrate after 60 mins by fluori...				Eur J Med Chem 127: 115-127 (2017) BindingDB Entry DOI: 10.7270/Q20K2BT4
					More data for this Ligand-Target Pair