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SMILES: FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F

InChI Key: InChIKey=KUJDJVANNWBCPM-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 = 280501   
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))
BDBM280501
PNG
(US10030020, Example 46 | US10781211, Example 46)
Show SMILES FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F
Show InChI InChI=1S/C26H30F9N3O3/c27-24(28,29)19-8-16(9-20(10-19)37-12-17-14-40-15-18(17)13-37)11-38-5-1-2-23(38)3-6-36(7-4-23)22(39)41-21(25(30,31)32)26(33,34)35/h8-10,17-18,21H,1-7,11-15H2
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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))
BDBM280501
PNG
(US10030020, Example 46 | US10781211, Example 46)
Show SMILES FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F
Show InChI InChI=1S/C26H30F9N3O3/c27-24(28,29)19-8-16(9-20(10-19)37-12-17-14-40-15-18(17)13-37)11-38-5-1-2-23(38)3-6-36(7-4-23)22(39)41-21(25(30,31)32)26(33,34)35/h8-10,17-18,21H,1-7,11-15H2
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))
BDBM280501
PNG
(US10030020, Example 46 | US10781211, Example 46)
Show SMILES FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F
Show InChI InChI=1S/C26H30F9N3O3/c27-24(28,29)19-8-16(9-20(10-19)37-12-17-14-40-15-18(17)13-37)11-38-5-1-2-23(38)3-6-36(7-4-23)22(39)41-21(25(30,31)32)26(33,34)35/h8-10,17-18,21H,1-7,11-15H2
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)


BindingDB Entry DOI: 10.7270/Q2RX9G56
More data for this
Ligand-Target Pair
Monoglyceride lipase


(Mus musculus (mouse))
BDBM280501
PNG
(US10030020, Example 46 | US10781211, Example 46)
Show SMILES FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F
Show InChI InChI=1S/C26H30F9N3O3/c27-24(28,29)19-8-16(9-20(10-19)37-12-17-14-40-15-18(17)13-37)11-38-5-1-2-23(38)3-6-36(7-4-23)22(39)41-21(25(30,31)32)26(33,34)35/h8-10,17-18,21H,1-7,11-15H2
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)


BindingDB Entry DOI: 10.7270/Q2RX9G56
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Mus musculus (mouse))
BDBM280501
PNG
(US10030020, Example 46 | US10781211, Example 46)
Show SMILES FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F
Show InChI InChI=1S/C26H30F9N3O3/c27-24(28,29)19-8-16(9-20(10-19)37-12-17-14-40-15-18(17)13-37)11-38-5-1-2-23(38)3-6-36(7-4-23)22(39)41-21(25(30,31)32)26(33,34)35/h8-10,17-18,21H,1-7,11-15H2
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)


BindingDB Entry DOI: 10.7270/Q2RX9G56
More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD2


(Mus musculus (Mouse))
BDBM280501
PNG
(US10030020, Example 46 | US10781211, Example 46)
Show SMILES FC(F)(F)C(OC(=O)N1CCC2(CCCN2Cc2cc(cc(c2)C(F)(F)F)N2CC3COCC3C2)CC1)C(F)(F)F
Show InChI InChI=1S/C26H30F9N3O3/c27-24(28,29)19-8-16(9-20(10-19)37-12-17-14-40-15-18(17)13-37)11-38-5-1-2-23(38)3-6-36(7-4-23)22(39)41-21(25(30,31)32)26(33,34)35/h8-10,17-18,21H,1-7,11-15H2
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