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SMILES: CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=CUNCINPZAVKHNI-UHFFFAOYSA-N

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 6 hits for monomerid = 280559   
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


(Mus musculus (mouse))
BDBM280559
PNG
(US10030020, Example 104 | US10781211, Example 104)
Show SMILES CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H33ClF6N4O3/c1-17(38)34-20-5-11-35(12-6-20)21-15-19(27)4-3-18(21)16-37-10-2-7-24(37)8-13-36(14-9-24)23(39)40-22(25(28,29)30)26(31,32)33/h3-4,15,20,22H,2,5-14,16H2,1H3,(H,34,38)
Reactome pathway
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
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)


BindingDB Entry DOI: 10.7270/Q2FX7CGF
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Mus musculus (mouse))
BDBM280559
PNG
(US10030020, Example 104 | US10781211, Example 104)
Show SMILES CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H33ClF6N4O3/c1-17(38)34-20-5-11-35(12-6-20)21-15-19(27)4-3-18(21)16-37-10-2-7-24(37)8-13-36(14-9-24)23(39)40-22(25(28,29)30)26(31,32)33/h3-4,15,20,22H,2,5-14,16H2,1H3,(H,34,38)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
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)


BindingDB Entry DOI: 10.7270/Q2FX7CGF
More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD6


(Mus musculus (mouse))
BDBM280559
PNG
(US10030020, Example 104 | US10781211, Example 104)
Show SMILES CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H33ClF6N4O3/c1-17(38)34-20-5-11-35(12-6-20)21-15-19(27)4-3-18(21)16-37-10-2-7-24(37)8-13-36(14-9-24)23(39)40-22(25(28,29)30)26(31,32)33/h3-4,15,20,22H,2,5-14,16H2,1H3,(H,34,38)
PDB

KEGG

UniProtKB/SwissProt

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



LUNDBECK LA JOLLA RESEARCH CENTER, INC.

US Patent


Assay Description
MAGL, ABHD6 and FAAH: Proteomes (mouse brain membrane fraction or cell lysates) (50 μL, 1.0 mg/mL total protein concentration) were preincubated...


US Patent US10781211 (2020)

More data for this
Ligand-Target Pair
Monoglyceride lipase


(Mus musculus (mouse))
BDBM280559
PNG
(US10030020, Example 104 | US10781211, Example 104)
Show SMILES CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H33ClF6N4O3/c1-17(38)34-20-5-11-35(12-6-20)21-15-19(27)4-3-18(21)16-37-10-2-7-24(37)8-13-36(14-9-24)23(39)40-22(25(28,29)30)26(31,32)33/h3-4,15,20,22H,2,5-14,16H2,1H3,(H,34,38)
Reactome pathway
KEGG

UniProtKB/SwissProt

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



LUNDBECK LA JOLLA RESEARCH CENTER, INC.

US Patent


Assay Description
MAGL, ABHD6 and FAAH: Proteomes (mouse brain membrane fraction or cell lysates) (50 μL, 1.0 mg/mL total protein concentration) were preincubated...


US Patent US10781211 (2020)

More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Mus musculus (mouse))
BDBM280559
PNG
(US10030020, Example 104 | US10781211, Example 104)
Show SMILES CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H33ClF6N4O3/c1-17(38)34-20-5-11-35(12-6-20)21-15-19(27)4-3-18(21)16-37-10-2-7-24(37)8-13-36(14-9-24)23(39)40-22(25(28,29)30)26(31,32)33/h3-4,15,20,22H,2,5-14,16H2,1H3,(H,34,38)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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



LUNDBECK LA JOLLA RESEARCH CENTER, INC.

US Patent


Assay Description
MAGL, ABHD6 and FAAH: Proteomes (mouse brain membrane fraction or cell lysates) (50 μL, 1.0 mg/mL total protein concentration) were preincubated...


US Patent US10781211 (2020)

More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD2


(Mus musculus (Mouse))
BDBM280559
PNG
(US10030020, Example 104 | US10781211, Example 104)
Show SMILES CC(=O)NC1CCN(CC1)c1cc(Cl)ccc1CN1CCCC11CCN(CC1)C(=O)OC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C26H33ClF6N4O3/c1-17(38)34-20-5-11-35(12-6-20)21-15-19(27)4-3-18(21)16-37-10-2-7-24(37)8-13-36(14-9-24)23(39)40-22(25(28,29)30)26(31,32)33/h3-4,15,20,22H,2,5-14,16H2,1H3,(H,34,38)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
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)


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