BDBM390787 US9957263, Example 49

SMILES: CS(=O)(=O)c1ccc(Oc2cccc(NS(=O)(=O)C3CC3)c2)c(c1)-c1c[nH]c(=O)c2[nH]ccc12

InChI Key: InChIKey=HFKHATVIWPJIKK-UHFFFAOYSA-N

Data: 2 KI

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 = 390787   

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))	BDBM390787 (US9957263, Example 49) Show SMILES CS(=O)(=O)c1ccc(Oc2cccc(NS(=O)(=O)C3CC3)c2)c(c1)-c1c[nH]c(=O)c2[nH]ccc12 Show InChI InChI=1S/C23H21N3O6S2/c1-33(28,29)17-7-8-21(19(12-17)20-13-25-23(27)22-18(20)9-10-24-22)32-15-4-2-3-14(11-15)26-34(30,31)16-5-6-16/h2-4,7-13,16,24,26H,5-6H2,1H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description Compound dilution series were prepared in DMSO via a 3-fold serial dilution from 2.5 mM to 42 nM. Compounds were then diluted 6:100 in assay buffer (...				Bioorg Med Chem Lett 19: 360-4 (2009) BindingDB Entry DOI: 10.7270/Q2Q81GDF
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM390787 (US9957263, Example 49) Show SMILES CS(=O)(=O)c1ccc(Oc2cccc(NS(=O)(=O)C3CC3)c2)c(c1)-c1c[nH]c(=O)c2[nH]ccc12 Show InChI InChI=1S/C23H21N3O6S2/c1-33(28,29)17-7-8-21(19(12-17)20-13-25-23(27)22-18(20)9-10-24-22)32-15-4-2-3-14(11-15)26-34(30,31)16-5-6-16/h2-4,7-13,16,24,26H,5-6H2,1H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	4.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description Compound dilution series were prepared in DMSO via a 3-fold serial dilution from 2.5 mM to 42 nM. Compounds were then diluted 6:100 in assay buffer (...				Bioorg Med Chem Lett 19: 360-4 (2009) BindingDB Entry DOI: 10.7270/Q2Q81GDF
					More data for this Ligand-Target Pair