BDBM50251052 CHEMBL4078807

SMILES: Cc1cc(cc(C)c1O)-c1nc2sc3CN(Cc4ccccc4)CCc3c2c(=O)[nH]1

InChI Key: InChIKey=VCFGSDOCXAJOMH-UHFFFAOYSA-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 = 50251052   

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))	BDBM50251052 (CHEMBL4078807) Show SMILES Cc1cc(cc(C)c1O)-c1nc2sc3CN(Cc4ccccc4)CCc3c2c(=O)[nH]1 Show InChI InChI=1S/C24H23N3O2S/c1-14-10-17(11-15(2)21(14)28)22-25-23(29)20-18-8-9-27(12-16-6-4-3-5-7-16)13-19(18)30-24(20)26-22/h3-7,10-11,28H,8-9,12-13H2,1-2H3,(H,25,26,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University and Collaborative Innovation Center of Biotherapy Curated by ChEMBL					Assay Description Inhibition of GST-tagged BRD4 bromodomain (unknown origin) using biotinylated histone H4KAc peptide (1 to 21 residues) as substrate by HTRF assay				J Med Chem 63: 3678-3700 (2020) Article DOI: 10.1021/acs.jmedchem.9b02178
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50251052 (CHEMBL4078807) Show SMILES Cc1cc(cc(C)c1O)-c1nc2sc3CN(Cc4ccccc4)CCc3c2c(=O)[nH]1 Show InChI InChI=1S/C24H23N3O2S/c1-14-10-17(11-15(2)21(14)28)22-25-23(29)20-18-8-9-27(12-16-6-4-3-5-7-16)13-19(18)30-24(20)26-22/h3-7,10-11,28H,8-9,12-13H2,1-2H3,(H,25,26,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of His/thioredoxin-tagged human recombinant BRD4 bromodomain-1 (43 to 166 residues) expressed in Escherichia coli BL21 Star (DE3) pre-incu...				J Med Chem 60: 9990-10012 (2017) Article DOI: 10.1021/acs.jmedchem.7b00275 BindingDB Entry DOI: 10.7270/Q2M32Z68
					More data for this Ligand-Target Pair