null

SMILES: CC(=O)N1CCc2c(C1)c(Nc1cccc(C)c1)nn2CCO

InChI Key: InChIKey=NPKBSQHTYBKPJD-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50200452   

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
CREB-binding protein/Histone acetyltransferase p300 (Homo sapiens (Human))	BDBM50200452 (CHEMBL3891576 | US9763922, Example 204) Show SMILES CC(=O)N1CCc2c(C1)c(Nc1cccc(C)c1)nn2CCO Show InChI InChI=1S/C17H22N4O2/c1-12-4-3-5-14(10-12)18-17-15-11-20(13(2)23)7-6-16(15)21(19-17)8-9-22/h3-5,10,22H,6-9,11H2,1-2H3,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Displacement of biotinylated ligand from recombinant His-tagged CBP/EP300 (unknown origin) measured after 10 mins by TR-FRET assay				J Med Chem 59: 10549-10563 (2016) Article DOI: 10.1021/acs.jmedchem.6b01022 BindingDB Entry DOI: 10.7270/Q27083DF
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50200452 (CHEMBL3891576 | US9763922, Example 204) Show SMILES CC(=O)N1CCc2c(C1)c(Nc1cccc(C)c1)nn2CCO Show InChI InChI=1S/C17H22N4O2/c1-12-4-3-5-14(10-12)18-17-15-11-20(13(2)23)7-6-16(15)21(19-17)8-9-22/h3-5,10,22H,6-9,11H2,1-2H3,(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC.; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged BRD4 BD142-168 was cloned, expressed, and purified to. BRD4 binding and inhibition was assessed by monitoring the engagement ...				US Patent US9763922 (2017) BindingDB Entry DOI: 10.7270/Q23N25G6
					More data for this Ligand-Target Pair
CREB-binding protein (Homo sapiens (Human))	BDBM50200452 (CHEMBL3891576 | US9763922, Example 204) Show SMILES CC(=O)N1CCc2c(C1)c(Nc1cccc(C)c1)nn2CCO Show InChI InChI=1S/C17H22N4O2/c1-12-4-3-5-14(10-12)18-17-15-11-20(13(2)23)7-6-16(15)21(19-17)8-9-22/h3-5,10,22H,6-9,11H2,1-2H3,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC.; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged CBP was cloned, expressed, and purified to homogeneity. CBP binding and inhibition was assessed by monitoring the engagement ...				US Patent US9763922 (2017) BindingDB Entry DOI: 10.7270/Q23N25G6
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50200452 (CHEMBL3891576 | US9763922, Example 204) Show SMILES CC(=O)N1CCc2c(C1)c(Nc1cccc(C)c1)nn2CCO Show InChI InChI=1S/C17H22N4O2/c1-12-4-3-5-14(10-12)18-17-15-11-20(13(2)23)7-6-16(15)21(19-17)8-9-22/h3-5,10,22H,6-9,11H2,1-2H3,(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Displacement of biotinylated ligand from recombinant His-tagged BRD4 bromodomain-1 (unknown origin) measured after 10 mins by TR-FRET assay				J Med Chem 59: 10549-10563 (2016) Article DOI: 10.1021/acs.jmedchem.6b01022 BindingDB Entry DOI: 10.7270/Q27083DF
					More data for this Ligand-Target Pair