BDBM50211277 CHEMBL3903742

SMILES: COc1ccc(CC2CCCCN2C(=O)n2ncc(n2)C(O)(c2ccc(F)cc2)c2ccc(F)cc2)cc1

InChI Key: InChIKey=NEJATSOZXGUICW-UHFFFAOYSA-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 = 50211277   

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
Sn1-specific diacylglycerol lipase alpha (Homo sapiens (Human))	BDBM50211277 (CHEMBL3903742) Show SMILES COc1ccc(CC2CCCCN2C(=O)n2ncc(n2)C(O)(c2ccc(F)cc2)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C29H28F2N4O3/c1-38-26-15-5-20(6-16-26)18-25-4-2-3-17-34(25)28(36)35-32-19-27(33-35)29(37,21-7-11-23(30)12-8-21)22-9-13-24(31)14-10-22/h5-16,19,25,37H,2-4,17-18H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of recombinant human DAGLalpha expressed in HEK293T cell membranes overexpressing MAGL using natural substrate 1-stearoyl-2-arachidonoly-s...				J Med Chem 60: 428-440 (2017) Article DOI: 10.1021/acs.jmedchem.6b01482 BindingDB Entry DOI: 10.7270/Q28K7C79
					More data for this Ligand-Target Pair
Monoacylglycerol lipase ABHD6 (Homo sapiens (Human))	BDBM50211277 (CHEMBL3903742) Show SMILES COc1ccc(CC2CCCCN2C(=O)n2ncc(n2)C(O)(c2ccc(F)cc2)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C29H28F2N4O3/c1-38-26-15-5-20(6-16-26)18-25-4-2-3-17-34(25)28(36)35-32-19-27(33-35)29(37,21-7-11-23(30)12-8-21)22-9-13-24(31)14-10-22/h5-16,19,25,37H,2-4,17-18H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University Curated by ChEMBL					Assay Description Inhibition of human ABHD6 using 2-AG as natural substrate by fluorescence based assay				J Med Chem 60: 428-440 (2017) Article DOI: 10.1021/acs.jmedchem.6b01482 BindingDB Entry DOI: 10.7270/Q28K7C79
					More data for this Ligand-Target Pair