BDBM444451 US10662159, Example 39

SMILES: CC1(C)C2C1C(=O)N(OC(=O)N1Cc3ccc(cc3C1)N1CCOCC1)C2=O

InChI Key: InChIKey=DNMWFBNUPQBNCK-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 444451   

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
Monoacylglycerol lipase ABHD6 (Homo sapiens (Human))	BDBM444451 (US10662159, Example 39) Show SMILES CC1(C)C2C1C(=O)N(OC(=O)N1Cc3ccc(cc3C1)N1CCOCC1)C2=O Show InChI InChI=1S/C20H23N3O5/c1-20(2)15-16(20)18(25)23(17(15)24)28-19(26)22-10-12-3-4-14(9-13(12)11-22)21-5-7-27-8-6-21/h3-4,9,15-16H,5-8,10-11H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
MAKSCIENTIFIC, LLC US Patent					Assay Description ABHD6: Certain compounds were tested for their ABHD6 and dual ABHD6/MGL inhibitory activity, which is expressed as % of inhibition or IC50 values. Th...				US Patent US10662159 (2020)
					More data for this Ligand-Target Pair
Fatty-acid amide hydrolase 1 (Homo sapiens (Human))	BDBM444451 (US10662159, Example 39) Show SMILES CC1(C)C2C1C(=O)N(OC(=O)N1Cc3ccc(cc3C1)N1CCOCC1)C2=O Show InChI InChI=1S/C20H23N3O5/c1-20(2)15-16(20)18(25)23(17(15)24)28-19(26)22-10-12-3-4-14(9-13(12)11-22)21-5-7-27-8-6-21/h3-4,9,15-16H,5-8,10-11H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
MAKSCIENTIFIC, LLC US Patent					Assay Description Rat/homo FAAH:Procedure was followed as described for hMGL, except that arachidonoyl-methyl coumarin (was used as fluorigenic substrate. Compounds we...				US Patent US10662159 (2020)
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM444451 (US10662159, Example 39) Show SMILES CC1(C)C2C1C(=O)N(OC(=O)N1Cc3ccc(cc3C1)N1CCOCC1)C2=O Show InChI InChI=1S/C20H23N3O5/c1-20(2)15-16(20)18(25)23(17(15)24)28-19(26)22-10-12-3-4-14(9-13(12)11-22)21-5-7-27-8-6-21/h3-4,9,15-16H,5-8,10-11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
MAKSCIENTIFIC, LLC US Patent					Assay Description MGL: Compound inhibition of hMGL activity was assessed by a fluorometric assay recently developed in our laboratory (Makriyannis et al WO Patent Appl...				US Patent US10662159 (2020)
					More data for this Ligand-Target Pair