BDBM50465533 CHEMBL4289190

SMILES: CCn1cnc2n(Cc3ccc(CNS(=O)(=O)c4ccc(C)cc4)cc3)c(=O)[nH]c(=O)c12

InChI Key: InChIKey=YPWOEZQECSJPBJ-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 = 50465533   

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
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50465533 (CHEMBL4289190) Show SMILES CCn1cnc2n(Cc3ccc(CNS(=O)(=O)c4ccc(C)cc4)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C22H23N5O4S/c1-3-26-14-23-20-19(26)21(28)25-22(29)27(20)13-17-8-6-16(7-9-17)12-24-32(30,31)18-10-4-15(2)5-11-18/h4-11,14,24H,3,12-13H2,1-2H3,(H,25,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	770	n/a	n/a	n/a	n/a	n/a
Aix-Marseille University Curated by ChEMBL					Assay Description Binding affinity to TEV cleavage site-fused-His-tagged BRD4(BD1) (unknown origin) by isothermal-titration calorimetry				J Med Chem 61: 5719-5732 (2018) Article DOI: 10.1021/acs.jmedchem.8b00653 BindingDB Entry DOI: 10.7270/Q2Q52S95
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50465533 (CHEMBL4289190) Show SMILES CCn1cnc2n(Cc3ccc(CNS(=O)(=O)c4ccc(C)cc4)cc3)c(=O)[nH]c(=O)c12 Show InChI InChI=1S/C22H23N5O4S/c1-3-26-14-23-20-19(26)21(28)25-22(29)27(20)13-17-8-6-16(7-9-17)12-24-32(30,31)18-10-4-15(2)5-11-18/h4-11,14,24H,3,12-13H2,1-2H3,(H,25,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	631	n/a	n/a	n/a	n/a	n/a	n/a
Aix-Marseille University Curated by ChEMBL					Assay Description Inhibition of TEV cleavage site-fused-GST tagged BRD4(BD1) (unknown origin) using SGRGK(Ac)CGK(Ac)-GLGK(Ac)GGAK(Ac)RHRKVG-peptide after 3 hrs by HTRF...				J Med Chem 61: 5719-5732 (2018) Article DOI: 10.1021/acs.jmedchem.8b00653 BindingDB Entry DOI: 10.7270/Q2Q52S95
					More data for this Ligand-Target Pair