BDBM50353594 CHEMBL1828984

SMILES: CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)=O

InChI Key: InChIKey=GAMMHRRBGXCHRX-UHFFFAOYSA-N

Data: 3 IC50

PDB links: 1 PDB ID matches this monomer.

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 3 hits for monomerid = 50353594   

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 2 (Homo sapiens (Human))	BDBM50353594 (CHEMBL1828984) Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)=O Show InChI InChI=1S/C14H15NO4/c1-4-18-12-6-10(5-11(7-12)14(16)17)13-8(2)15-19-9(13)3/h5-7H,4H2,1-3H3,(H,16,17)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Displacement of H4Ac4 peptide from first bromodomain of human BRD2 by peptide displacement assay				J Med Chem 54: 6761-70 (2011) Article DOI: 10.1021/jm200640v BindingDB Entry DOI: 10.7270/Q2RV0P3P
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50353594 (CHEMBL1828984) Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)=O Show InChI InChI=1S/C14H15NO4/c1-4-18-12-6-10(5-11(7-12)14(16)17)13-8(2)15-19-9(13)3/h5-7H,4H2,1-3H3,(H,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	5.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Displacement of H4Ac4 peptide from first bromodomain of human BRD4 by peptide displacement assay				J Med Chem 54: 6761-70 (2011) Article DOI: 10.1021/jm200640v BindingDB Entry DOI: 10.7270/Q2RV0P3P
					More data for this Ligand-Target Pair
CREB-binding protein (Homo sapiens (Human))	BDBM50353594 (CHEMBL1828984) Show SMILES CCOc1cc(cc(c1)-c1c(C)noc1C)C(O)=O Show InChI InChI=1S/C14H15NO4/c1-4-18-12-6-10(5-11(7-12)14(16)17)13-8(2)15-19-9(13)3/h5-7H,4H2,1-3H3,(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	3.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Displacement of H3K56Ac from human CREBBP by peptide displacement assay				J Med Chem 54: 6761-70 (2011) Article DOI: 10.1021/jm200640v BindingDB Entry DOI: 10.7270/Q2RV0P3P
					More data for this Ligand-Target Pair				3D Structure (crystal)