BDBM50322702 4-((4-((3-(4-tert-butylbenzyl)-2,4-dioxothiazolidin-5-ylidene)methyl)-2-methoxyphenoxy)methyl)benzoic acid::CHEMBL1173234

SMILES: COc1cc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(C)(C)C)C2=O)ccc1OCc1ccc(cc1)C(O)=O

InChI Key: InChIKey=ABGXPXJMRRMUKP-QQXSKIMKSA-N

Data: 2 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 2 hits for monomerid = 50322702   

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 (Homo sapiens (Human))	BDBM50322702 (4-((4-((3-(4-tert-butylbenzyl)-2,4-dioxothiazolidi...) Show SMILES COc1cc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(C)(C)C)C2=O)ccc1OCc1ccc(cc1)C(O)=O Show InChI InChI=1S/C30H29NO6S/c1-30(2,3)23-12-7-19(8-13-23)17-31-27(32)26(38-29(31)35)16-21-9-14-24(25(15-21)36-4)37-18-20-5-10-22(11-6-20)28(33)34/h5-16H,17-18H2,1-4H3,(H,33,34)/b26-16-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Inhibition of 6x-histidine-tagged human recombinant ATX expressed in HEK293 cells assessed as lysophosphatidulcholine release				J Med Chem 53: 4958-67 (2010) Article DOI: 10.1021/jm1005012 BindingDB Entry DOI: 10.7270/Q2G73DXK
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Homo sapiens (Human))	BDBM50322702 (4-((4-((3-(4-tert-butylbenzyl)-2,4-dioxothiazolidi...) Show SMILES COc1cc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(C)(C)C)C2=O)ccc1OCc1ccc(cc1)C(O)=O Show InChI InChI=1S/C30H29NO6S/c1-30(2,3)23-12-7-19(8-13-23)17-31-27(32)26(38-29(31)35)16-21-9-14-24(25(15-21)36-4)37-18-20-5-10-22(11-6-20)28(33)34/h5-16H,17-18H2,1-4H3,(H,33,34)/b26-16-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Inhibition of 6x-histidine-tagged human recombinant ATX expressed in HEK293 cells using bisP-nitrophenyl phosphate as a substrate				J Med Chem 53: 4958-67 (2010) Article DOI: 10.1021/jm1005012 BindingDB Entry DOI: 10.7270/Q2G73DXK
					More data for this Ligand-Target Pair