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BDBM280544 US10030020, Example 89

SMILES: CC(C)(C)c1ccc(CN2CCCC22CCN(CC2)C(=O)OC(C(F)(F)F)C(F)(F)F)c(c1)N1CCN(CC1)S(C)(=O)=O

InChI Key: InChIKey=LLOZUXMRSJMNND-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 280544   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Monoglyceride Lipase (MGL)


(Mus musculus (mouse))
BDBM280544
PNG
(US10030020, Example 89)
Show SMILES CC(C)(C)c1ccc(CN2CCCC22CCN(CC2)C(=O)OC(C(F)(F)F)C(F)(F)F)c(c1)N1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C28H40F6N4O4S/c1-25(2,3)21-7-6-20(22(18-21)35-14-16-38(17-15-35)43(4,40)41)19-37-11-5-8-26(37)9-12-36(13-10-26)24(39)42-23(27(29,30)31)28(32,33)34/h6-7,18,23H,5,8-17,19H2,1-4H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



ABIDE THERAPEUTICS, INC.

US Patent


Assay Description
Proteomes (mouse brain membrane fraction or cell lysates) (50 μL, 1.0 mg/mL total protein concentration) were preincubated with varying concentr...


US Patent US10030020 (2018)


Article DOI: 10.1021/jm0606138
BindingDB Entry DOI: 10.7270/Q2FX7CGF
More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD2


(Mus musculus (Mouse))
BDBM280544
PNG
(US10030020, Example 89)
Show SMILES CC(C)(C)c1ccc(CN2CCCC22CCN(CC2)C(=O)OC(C(F)(F)F)C(F)(F)F)c(c1)N1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C28H40F6N4O4S/c1-25(2,3)21-7-6-20(22(18-21)35-14-16-38(17-15-35)43(4,40)41)19-37-11-5-8-26(37)9-12-36(13-10-26)24(39)42-23(27(29,30)31)28(32,33)34/h6-7,18,23H,5,8-17,19H2,1-4H3
UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a>1.00E+3n/an/an/an/an/an/a



ABIDE THERAPEUTICS, INC.

US Patent


Assay Description
Proteomes (mouse brain membrane fraction or cell lysates) (50 μL, 1.0 mg/mL total protein concentration) were preincubated with varying concentr...


US Patent US10030020 (2018)


Article DOI: 10.1021/jm0606138
BindingDB Entry DOI: 10.7270/Q2FX7CGF
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Mus musculus (mouse))
BDBM280544
PNG
(US10030020, Example 89)
Show SMILES CC(C)(C)c1ccc(CN2CCCC22CCN(CC2)C(=O)OC(C(F)(F)F)C(F)(F)F)c(c1)N1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C28H40F6N4O4S/c1-25(2,3)21-7-6-20(22(18-21)35-14-16-38(17-15-35)43(4,40)41)19-37-11-5-8-26(37)9-12-36(13-10-26)24(39)42-23(27(29,30)31)28(32,33)34/h6-7,18,23H,5,8-17,19H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a>1.00E+3n/an/an/an/an/an/a



ABIDE THERAPEUTICS, INC.

US Patent


Assay Description
Proteomes (mouse brain membrane fraction or cell lysates) (50 μL, 1.0 mg/mL total protein concentration) were preincubated with varying concentr...


US Patent US10030020 (2018)


Article DOI: 10.1021/jm0606138
BindingDB Entry DOI: 10.7270/Q2FX7CGF
More data for this
Ligand-Target Pair