BDBM50377931 CHEMBL1791402

SMILES: CC[C@@H](C)[C@H](NC(=O)[C@@H](N)Cc1cn(OC)c2ccccc12)C(=O)N1CCCC[C@@H]1C(=O)N[C@@H](CCCCCC(=O)CC)C(O)=O

InChI Key: InChIKey=WGYDJUMLABBZSI-VWIQTCEGSA-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 = 50377931   

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 4 (Homo sapiens (Human))	BDBM50377931 (CHEMBL1791402) Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](N)Cc1cn(OC)c2ccccc12)C(=O)N1CCCC[C@@H]1C(=O)N[C@@H](CCCCCC(=O)CC)C(O)=O |r| Show InChI InChI=1S/C34H51N5O7/c1-5-22(3)30(37-31(41)26(35)20-23-21-39(46-4)28-17-11-10-15-25(23)28)33(43)38-19-13-12-18-29(38)32(42)36-27(34(44)45)16-9-7-8-14-24(40)6-2/h10-11,15,17,21-22,26-27,29-30H,5-9,12-14,16,18-20,35H2,1-4H3,(H,36,42)(H,37,41)(H,44,45)/t22-,26+,27+,29-,30+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Ricerche di Biologia Molecolare Curated by ChEMBL					Assay Description Inhibition of flag-tagged HDAC4 by Biomol assay				Proc Natl Acad Sci USA 104: 17335-40 (2007) Article DOI: 10.1073/pnas.0706487104 BindingDB Entry DOI: 10.7270/Q2C82B5X
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50377931 (CHEMBL1791402) Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](N)Cc1cn(OC)c2ccccc12)C(=O)N1CCCC[C@@H]1C(=O)N[C@@H](CCCCCC(=O)CC)C(O)=O |r| Show InChI InChI=1S/C34H51N5O7/c1-5-22(3)30(37-31(41)26(35)20-23-21-39(46-4)28-17-11-10-15-25(23)28)33(43)38-19-13-12-18-29(38)32(42)36-27(34(44)45)16-9-7-8-14-24(40)6-2/h10-11,15,17,21-22,26-27,29-30H,5-9,12-14,16,18-20,35H2,1-4H3,(H,36,42)(H,37,41)(H,44,45)/t22-,26+,27+,29-,30+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	152	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Ricerche di Biologia Molecolare Curated by ChEMBL					Assay Description Inhibition of flag-tagged HDAC4 by pull-down assay				Proc Natl Acad Sci USA 104: 17335-40 (2007) Article DOI: 10.1073/pnas.0706487104 BindingDB Entry DOI: 10.7270/Q2C82B5X
					More data for this Ligand-Target Pair