BDBM50265845 CHEMBL4086093

SMILES: ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1

InChI Key: InChIKey=PZZNYQXMSCXZEE-INIZCTEOSA-N

Data: 9 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 9 hits for monomerid = 50265845   

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 5 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 5 in human HeLa nuclear extract using fluorogenic HDAC class 2A substrate measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 9 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 9 in human HeLa nuclear extract using fluorogenic HDAC class 2A substrate measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 10 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 10 in human HeLa nuclear extract measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	415	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 1 in human HeLa nuclear extract using HDAC substrate-3 measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 11 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 11 in human HeLa nuclear extract using fluorogenic HDAC class 2A substrate measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	368	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 3 in human HeLa nuclear extract using HDAC substrate-3 measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	211	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 8 in human HeLa nuclear extract using fluorogenic HDAC class 2A substrate measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 4 in human HeLa nuclear extract using fluorogenic HDAC class 2A substrate measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50265845 (CHEMBL4086093) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1CN1CC[C@H](O)C1 |r| Show InChI InChI=1S/C19H29N3O4/c23-16-11-12-22(14-16)13-15-7-5-6-8-17(15)20-18(24)9-3-1-2-4-10-19(25)21-26/h5-8,16,23,26H,1-4,9-14H2,(H,20,24)(H,21,25)/t16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	268	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Indian Institute of Integrative Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC 2 in human HeLa nuclear extract using HDAC substrate-3 measured after 60 mins by fluorometric analysis				J Med Chem 60: 3484-3497 (2017) Article DOI: 10.1021/acs.jmedchem.7b00322 BindingDB Entry DOI: 10.7270/Q2ZG6VQ5
					More data for this Ligand-Target Pair