BDBM50187105 (E)-3-(4-(4-methoxybenzylamino)phenyl)-N-(2-aminophenyl)acrylamide::3-(4-(4-methoxybenzylamino)phenyl)-N-(2-aminophenyl)acrylamide::CHEMBL211320

SMILES: COc1ccc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc1

InChI Key: InChIKey=TXUXBAHHONQYQS-XNTDXEJSSA-N

Data: 2 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 2 hits for monomerid = 50187105   

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))	BDBM50187105 ((E)-3-(4-(4-methoxybenzylamino)phenyl)-N-(2-aminop...) Show SMILES COc1ccc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc1 Show InChI InChI=1S/C23H23N3O2/c1-28-20-13-8-18(9-14-20)16-25-19-11-6-17(7-12-19)10-15-23(27)26-22-5-3-2-4-21(22)24/h2-15,25H,16,24H2,1H3,(H,26,27)/b15-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche Curated by ChEMBL					Assay Description Inhibition of HDAC1				J Med Chem 51: 1505-29 (2008) Article DOI: 10.1021/jm7011408 BindingDB Entry DOI: 10.7270/Q2M32WMT
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50187105 ((E)-3-(4-(4-methoxybenzylamino)phenyl)-N-(2-aminop...) Show SMILES COc1ccc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc1 Show InChI InChI=1S/C23H23N3O2/c1-28-20-13-8-18(9-14-20)16-25-19-11-6-17(7-12-19)10-15-23(27)26-22-5-3-2-4-21(22)24/h2-15,25H,16,24H2,1H3,(H,26,27)/b15-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
MethylGene Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC1				Bioorg Med Chem Lett 16: 4048-52 (2006) Article DOI: 10.1016/j.bmcl.2006.05.005 BindingDB Entry DOI: 10.7270/Q2CF9PP5
					More data for this Ligand-Target Pair