BDBM50540612 CHEMBL4636622

SMILES: ONC(=O)c1ccc(CN2CCc3ccc(F)cc23)cc1

InChI Key: InChIKey=ZQUOSIOGVTWRBG-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

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 = 50540612   

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 (Mus musculus)	BDBM50540612 (CHEMBL4636622) Show SMILES ONC(=O)c1ccc(CN2CCc3ccc(F)cc23)cc1 Show InChI InChI=1S/C16H15FN2O2/c17-14-6-5-12-7-8-19(15(12)9-14)10-11-1-3-13(4-2-11)16(20)18-21/h1-6,9,21H,7-8,10H2,(H,18,20)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	250	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC6 in mouse N2A cells assessed as increase in alpha tubulin acetylation				ACS Med Chem Lett 11: 706-712 (2020)
					More data for this Ligand-Target Pair
Histone deacetylase (Mus musculus)	BDBM50540612 (CHEMBL4636622) Show SMILES ONC(=O)c1ccc(CN2CCc3ccc(F)cc23)cc1 Show InChI InChI=1S/C16H15FN2O2/c17-14-6-5-12-7-8-19(15(12)9-14)10-11-1-3-13(4-2-11)16(20)18-21/h1-6,9,21H,7-8,10H2,(H,18,20)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	9.70	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC6 in mouse N2A cells				ACS Med Chem Lett 11: 706-712 (2020)
					More data for this Ligand-Target Pair
Histone deacetylase 1/2 (Mus musculus (Mouse))	BDBM50540612 (CHEMBL4636622) Show SMILES ONC(=O)c1ccc(CN2CCc3ccc(F)cc23)cc1 Show InChI InChI=1S/C16H15FN2O2/c17-14-6-5-12-7-8-19(15(12)9-14)10-11-1-3-13(4-2-11)16(20)18-21/h1-6,9,21H,7-8,10H2,(H,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	5.54E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of HDAC1 in mouse N2A cells				ACS Med Chem Lett 11: 706-712 (2020)
					More data for this Ligand-Target Pair