BDBM50366279 CHEMBL4165932

SMILES: CN1CCN(Cc2cn(CC(=O)N3CCCCC3)c3cc(NC(=S)NCCc4c[nH]c5ccccc45)ccc23)CC1

InChI Key: InChIKey=MKDURIHAVNZYLM-UHFFFAOYSA-N

Data: 1 IC50  1 Kd

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 = 50366279   

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
BCoR-BCL6 (Homo sapiens)	BDBM50366279 (CHEMBL4165932) Show SMILES CN1CCN(Cc2cn(CC(=O)N3CCCCC3)c3cc(NC(=S)NCCc4c[nH]c5ccccc45)ccc23)CC1 Show InChI InChI=1S/C32H41N7OS/c1-36-15-17-37(18-16-36)21-25-22-39(23-31(40)38-13-5-2-6-14-38)30-19-26(9-10-28(25)30)35-32(41)33-12-11-24-20-34-29-8-4-3-7-27(24)29/h3-4,7-10,19-20,22,34H,2,5-6,11-18,21,23H2,1H3,(H2,33,35,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.05E+5	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Binding affinity to isotopically labeled and N-terminal thioredoxin-His6 tag with N-terminal thrombin-cleavage site containing recombinant BCL6 BTB d...				J Med Chem 61: 7573-7588 (2018) Article DOI: 10.1021/acs.jmedchem.8b00040 BindingDB Entry DOI: 10.7270/Q27M0BGD
					More data for this Ligand-Target Pair
BCoR-BCL6 (Homo sapiens)	BDBM50366279 (CHEMBL4165932) Show SMILES CN1CCN(Cc2cn(CC(=O)N3CCCCC3)c3cc(NC(=S)NCCc4c[nH]c5ccccc45)ccc23)CC1 Show InChI InChI=1S/C32H41N7OS/c1-36-15-17-37(18-16-36)21-25-22-39(23-31(40)38-13-5-2-6-14-38)30-19-26(9-10-28(25)30)35-32(41)33-12-11-24-20-34-29-8-4-3-7-27(24)29/h3-4,7-10,19-20,22,34H,2,5-6,11-18,21,23H2,1H3,(H2,33,35,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Binding affinity to N-terminal thioredoxin-His6 tag with N-terminal thrombin-cleavage site containing recombinant BCL6 BTB domain C8Q/C67R/C84N/E99V ...				J Med Chem 61: 7573-7588 (2018) Article DOI: 10.1021/acs.jmedchem.8b00040 BindingDB Entry DOI: 10.7270/Q27M0BGD
					More data for this Ligand-Target Pair