BDBM50264242 CHEMBL4062177

SMILES: COC(=O)[C@H](CCC(=O)NO)NC(=O)CCCCC(=O)Nc1ccc(OC)cc1

InChI Key: InChIKey=ZHLAPIUYSSONKV-HNNXBMFYSA-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 = 50264242   

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)	BDBM50264242 (CHEMBL4062177) Show SMILES COC(=O)[C@H](CCC(=O)NO)NC(=O)CCCCC(=O)Nc1ccc(OC)cc1 |r| Show InChI InChI=1S/C19H27N3O7/c1-28-14-9-7-13(8-10-14)20-16(23)5-3-4-6-17(24)21-15(19(26)29-2)11-12-18(25)22-27/h7-10,15,27H,3-6,11-12H2,1-2H3,(H,20,23)(H,21,24)(H,22,25)/t15-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
National and Kapodistrian University of Athens Curated by ChEMBL					Assay Description Inhibition of mouse ATX-beta using LPC 16:0 as substrate by Amplex Red PLD assay				J Med Chem 61: 3697-3711 (2018) Article DOI: 10.1021/acs.jmedchem.8b00232 BindingDB Entry DOI: 10.7270/Q2Q52S3G
					More data for this Ligand-Target Pair