BDBM50372463 CHEMBL272402

SMILES: CN1CCCCC1N[C@@H](CCCCCC(C)=O)C(=O)Nc1cccc(c1)-c1ccccc1

InChI Key: InChIKey=CIUMTXQEHQJOHY-PMCHYTPCSA-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 = 50372463   

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))	BDBM50372463 (CHEMBL272402) Show SMILES CN1CCCCC1N[C@@H](CCCCCC(C)=O)C(=O)Nc1cccc(c1)-c1ccccc1 |w:6.7| Show InChI InChI=1S/C27H37N3O2/c1-21(31)12-5-3-8-17-25(29-26-18-9-10-19-30(26)2)27(32)28-24-16-11-15-23(20-24)22-13-6-4-7-14-22/h4,6-7,11,13-16,20,25-26,29H,3,5,8-10,12,17-19H2,1-2H3,(H,28,32)/t25-,26?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche Curated by ChEMBL					Assay Description Inhibition of HDAC1 from human HeLa cells				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))	BDBM50372463 (CHEMBL272402) Show SMILES CN1CCCCC1N[C@@H](CCCCCC(C)=O)C(=O)Nc1cccc(c1)-c1ccccc1 |w:6.7| Show InChI InChI=1S/C27H37N3O2/c1-21(31)12-5-3-8-17-25(29-26-18-9-10-19-30(26)2)27(32)28-24-16-11-15-23(20-24)22-13-6-4-7-14-22/h4,6-7,11,13-16,20,25-26,29H,3,5,8-10,12,17-19H2,1-2H3,(H,28,32)/t25-,26?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Menarini Ricerche Curated by ChEMBL					Assay Description Inhibition of human 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