BDBM50177030 CHEMBL3813927

SMILES: OP(O)(=O)c1ccccc1OCC(=O)Nc1cccc(Cl)c1Cl

InChI Key: InChIKey=JRORPYPDXOLPLV-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50177030   

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
14-3-3 protein sigma (Homo sapiens (Human))	BDBM50177030 (CHEMBL3813927) Show SMILES OP(O)(=O)c1ccccc1OCC(=O)Nc1cccc(Cl)c1Cl Show InChI InChI=1S/C14H12Cl2NO5P/c15-9-4-3-5-10(14(9)16)17-13(18)8-22-11-6-1-2-7-12(11)23(19,20)21/h1-7H,8H2,(H,17,18)(H2,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
RIKEN Curated by ChEMBL					Assay Description Inhibition of 14-3-3sigma (unknown origin) assessed as reduction in 14-3-3sigma- mediated increase in MMP1 mRNA by cell based assay				Bioorg Med Chem 24: 3246-54 (2016) BindingDB Entry DOI: 10.7270/Q2JD4ZQ7
					More data for this Ligand-Target Pair				3D Structure (crystal)