BDBM347497 US9790180, ID 030

SMILES: CC1(CCN(CC1)C(=O)N1CCCC1)Nc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1ccncc1

InChI Key: InChIKey=SQXVROULDNVPOP-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 = 347497   

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))	BDBM347497 (US9790180, ID 030) Show SMILES CC1(CCN(CC1)C(=O)N1CCCC1)Nc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1ccncc1 Show InChI InChI=1S/C29H34N6O2/c1-29(12-18-35(19-13-29)28(37)34-16-2-3-17-34)33-24-7-4-22(5-8-24)27(36)32-26-20-23(6-9-25(26)30)21-10-14-31-15-11-21/h4-11,14-15,20,33H,2-3,12-13,16-19,30H2,1H3,(H,32,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, LLC US Patent					Assay Description Compounds for testing were diluted in DMSO to 50 fold the final concentration and a ten point three fold dilution series was made. The compounds were...				US Patent US9790180 (2017) BindingDB Entry DOI: 10.7270/Q2GF0WM8
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM347497 (US9790180, ID 030) Show SMILES CC1(CCN(CC1)C(=O)N1CCCC1)Nc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1ccncc1 Show InChI InChI=1S/C29H34N6O2/c1-29(12-18-35(19-13-29)28(37)34-16-2-3-17-34)33-24-7-4-22(5-8-24)27(36)32-26-20-23(6-9-25(26)30)21-10-14-31-15-11-21/h4-11,14-15,20,33H,2-3,12-13,16-19,30H2,1H3,(H,32,36)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	466	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, LLC US Patent									US Patent US9790180 (2017) BindingDB Entry DOI: 10.7270/Q2GF0WM8
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM347497 (US9790180, ID 030) Show SMILES CC1(CCN(CC1)C(=O)N1CCCC1)Nc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1ccncc1 Show InChI InChI=1S/C29H34N6O2/c1-29(12-18-35(19-13-29)28(37)34-16-2-3-17-34)33-24-7-4-22(5-8-24)27(36)32-26-20-23(6-9-25(26)30)21-10-14-31-15-11-21/h4-11,14-15,20,33H,2-3,12-13,16-19,30H2,1H3,(H,32,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.40	n/a	n/a	n/a	n/a	n/a	n/a
REGENACY PHARMACEUTICALS, LLC US Patent									US Patent US9790180 (2017) BindingDB Entry DOI: 10.7270/Q2GF0WM8
					More data for this Ligand-Target Pair