BDBM50150955 CHEMBL3774993

SMILES: CN(c1ccc(OCCCCCC(=O)NO)cc1)c1ncnc2ccccc12

InChI Key: InChIKey=NXBDQDGEFPQVSI-UHFFFAOYSA-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 = 50150955   

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))	BDBM50150955 (CHEMBL3774993) Show SMILES CN(c1ccc(OCCCCCC(=O)NO)cc1)c1ncnc2ccccc12 Show InChI InChI=1S/C21H24N4O3/c1-25(21-18-7-4-5-8-19(18)22-15-23-21)16-10-12-17(13-11-16)28-14-6-2-3-9-20(26)24-27/h4-5,7-8,10-13,15,27H,2-3,6,9,14H2,1H3,(H,24,26)	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	176	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of KDM5B (unknown origin) using biotin-H3K4me3 as substrate preincubated for 15 mins followed by substrate addition measured after 20 mins...				J Med Chem 59: 1455-70 (2016) BindingDB Entry DOI: 10.7270/Q2T155H3
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50150955 (CHEMBL3774993) Show SMILES CN(c1ccc(OCCCCCC(=O)NO)cc1)c1ncnc2ccccc12 Show InChI InChI=1S/C21H24N4O3/c1-25(21-18-7-4-5-8-19(18)22-15-23-21)16-10-12-17(13-11-16)28-14-6-2-3-9-20(26)24-27/h4-5,7-8,10-13,15,27H,2-3,6,9,14H2,1H3,(H,24,26)	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	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of KDM5C (unknown origin) using biotin-H3K4me3 as substrate preincubated for 15 mins followed by substrate addition measured after 20 mins...				J Med Chem 59: 1455-70 (2016) BindingDB Entry DOI: 10.7270/Q2T155H3
					More data for this Ligand-Target Pair
Cereblon/Histone deacetylase 6 (Homo sapiens (Human))	BDBM50150955 (CHEMBL3774993) Show SMILES CN(c1ccc(OCCCCCC(=O)NO)cc1)c1ncnc2ccccc12 Show InChI InChI=1S/C21H24N4O3/c1-25(21-18-7-4-5-8-19(18)22-15-23-21)16-10-12-17(13-11-16)28-14-6-2-3-9-20(26)24-27/h4-5,7-8,10-13,15,27H,2-3,6,9,14H2,1H3,(H,24,26)	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	19	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of KDM5B (unknown origin) using biotin-H3K4me3 as substrate preincubated for 15 mins followed by substrate addition measured after 20 mins...				J Med Chem 59: 1455-70 (2016) BindingDB Entry DOI: 10.7270/Q2T155H3
					More data for this Ligand-Target Pair