BDBM50266943 CHEMBL4102883

SMILES: OB(O)c1ccccc1CCN1CCN(CC1)c1nc(O)c(Cc2ccc(Cl)c(Cl)c2)s1

InChI Key: InChIKey=BMYYEIFBFFDUSE-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50266943   

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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Mus musculus)	BDBM50266943 (CHEMBL4102883) Show SMILES OB(O)c1ccccc1CCN1CCN(CC1)c1nc(O)c(Cc2ccc(Cl)c(Cl)c2)s1 Show InChI InChI=1S/C22H24BCl2N3O3S/c24-18-6-5-15(13-19(18)25)14-20-21(29)26-22(32-20)28-11-9-27(10-12-28)8-7-16-3-1-2-4-17(16)23(30)31/h1-6,13,29-31H,7-12,14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	631	n/a	n/a	n/a	n/a	n/a	n/a
Takeda California, Inc. Curated by ChEMBL					Assay Description Inhibition of mouse ATX using TG-mTMP as substrate after 2 hrs by fluorometric analysis				J Med Chem 60: 5209-5215 (2017) Article DOI: 10.1021/acs.jmedchem.6b01224 BindingDB Entry DOI: 10.7270/Q2319ZCT
					More data for this Ligand-Target Pair