BindingDB logo
myBDB logout

Patent code US9963444

Compile Data Set for Download or QSAR
Found 117 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393391
PNG
(3-((4'-Cyano-5-phenoxy-[1,1'-biphenyl]-2-yl)methox...)
Show SMILES N#CN1CC(C1)OCc1ccc(Oc2ccccc2)cc1-c1ccc(cc1)C#N
Show InChI InChI=1S/C24H19N3O2/c25-13-18-6-8-19(9-7-18)24-12-22(29-21-4-2-1-3-5-21)11-10-20(24)16-28-23-14-27(15-23)17-26/h1-12,23H,14-16H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393335
PNG
(6-(3-Fluoro-4-(((1S,3S)-3-isothiocyanatocyclobutox...)
Show SMILES Fc1cc(ccc1CO[C@H]1C[C@H](C1)N=C=S)-c1ccc2OCCOc2c1
Show InChI InChI=1S/C20H18FNO3S/c21-18-7-13(14-3-4-19-20(8-14)24-6-5-23-19)1-2-15(18)11-25-17-9-16(10-17)22-12-26/h1-4,7-8,16-17H,5-6,9-11H2/t16-,17+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393350
PNG
(3-Fluoro-4'-((1S,3S)-3-isothiocyanatocyclobutoxy)-...)
Show SMILES COc1ccc(cc1F)-c1ccc(O[C@H]2C[C@H](C2)N=C=S)cc1
Show InChI InChI=1S/C18H16FNO2S/c1-21-18-7-4-13(8-17(18)19)12-2-5-15(6-3-12)22-16-9-14(10-16)20-11-23/h2-8,14,16H,9-10H2,1H3/t14-,16+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393363
PNG
(3-([1,1'-Biphenyl]-4-ylmethoxy)azetidine-1-carboni...)
Show SMILES N#CN1CC(C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C17H16N2O/c18-13-19-10-17(11-19)20-12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17H,10-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393366
PNG
(3-((3'-Methoxy-[1,1'-biphenyl]-4-yl)methoxy)azetid...)
Show SMILES COc1cccc(c1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C18H18N2O2/c1-21-17-4-2-3-16(9-17)15-7-5-14(6-8-15)12-22-18-10-20(11-18)13-19/h2-9,18H,10-12H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393386
PNG
(US9963444, Example 87 | rrr)
Show SMILES N#CN1CC(C1)OCc1ccc(Oc2ccccc2)cc1-c1ccccc1
Show InChI InChI=1S/C23H20N2O2/c24-17-25-14-22(15-25)26-16-19-11-12-21(27-20-9-5-2-6-10-20)13-23(19)18-7-3-1-4-8-18/h1-13,22H,14-16H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393390
PNG
(3-((2-(2-Methoxypyridin-3-yl)-4-phenoxybenzyl)oxy)...)
Show SMILES COc1ncccc1-c1cc(Oc2ccccc2)ccc1COC1CN(C1)C#N
Show InChI InChI=1S/C23H21N3O3/c1-27-23-21(8-5-11-25-23)22-12-19(29-18-6-3-2-4-7-18)10-9-17(22)15-28-20-13-26(14-20)16-24/h2-12,20H,13-15H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393401
PNG
(3-((4-(1-Methyl-1H-pyrazol-4-yl)phenyl)(phenyl)met...)
Show SMILES Cn1cc(cn1)-c1ccc(cc1)C(OC1CN(C1)C#N)c1ccccc1
Show InChI InChI=1S/C21H20N4O/c1-24-12-19(11-23-24)16-7-9-18(10-8-16)21(17-5-3-2-4-6-17)26-20-13-25(14-20)15-22/h2-12,20-21H,13-14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393301
PNG
((10-Isothiocyanatodecyl)benzene | US9963444, Examp...)
Show SMILES S=C=NCCCCCCCCCCc1ccccc1
Show InChI InChI=1S/C17H25NS/c19-16-18-15-11-6-4-2-1-3-5-8-12-17-13-9-7-10-14-17/h7,9-10,13-14H,1-6,8,11-12,15H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393315
PNG
(2-(10-Isothiocyanatodecyl)pyridine | US9963444, Ex...)
Show SMILES S=C=NCCCCCCCCCCc1ccccn1
Show InChI InChI=1S/C16H24N2S/c19-15-17-13-9-6-4-2-1-3-5-7-11-16-12-8-10-14-18-16/h8,10,12,14H,1-7,9,11,13H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393369
PNG
(3-((3'-(Trifluoromethyl)-[1,1'-biphenyl]-4-yl)meth...)
Show SMILES FC(F)(F)c1cccc(c1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C18H15F3N2O/c19-18(20,21)16-3-1-2-15(8-16)14-6-4-13(5-7-14)11-24-17-9-23(10-17)12-22/h1-8,17H,9-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393374
PNG
(3-((2'-Methoxy-[1,1'-biphenyl]-4-yl)methoxy)azetid...)
Show SMILES COc1ccccc1-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C18H18N2O2/c1-21-18-5-3-2-4-17(18)15-8-6-14(7-9-15)12-22-16-10-20(11-16)13-19/h2-9,16H,10-12H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393384
PNG
(US9963444, Example 85 | rrr)
Show SMILES N#CN1CC(C1)OCc1ccc(cc1)-c1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C24H22N2O2/c25-18-26-14-24(15-26)28-17-20-9-11-21(12-10-20)22-7-4-8-23(13-22)27-16-19-5-2-1-3-6-19/h1-13,24H,14-17H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393387
PNG
(3-((2'-Methoxy-5-phenoxy-[1,1'-biphenyl]-2-yl)meth...)
Show SMILES COc1ccccc1-c1cc(Oc2ccccc2)ccc1COC1CN(C1)C#N
Show InChI InChI=1S/C24H22N2O3/c1-27-24-10-6-5-9-22(24)23-13-20(29-19-7-3-2-4-8-19)12-11-18(23)16-28-21-14-26(15-21)17-25/h2-13,21H,14-16H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393392
PNG
(3-((2'-Cyano-5-phenoxy-[1,1'-biphenyl]-2-yl)methox...)
Show SMILES N#CN1CC(C1)OCc1ccc(Oc2ccccc2)cc1-c1ccccc1C#N
Show InChI InChI=1S/C24H19N3O2/c25-13-18-6-4-5-9-23(18)24-12-21(29-20-7-2-1-3-8-20)11-10-19(24)16-28-22-14-27(15-22)17-26/h1-12,22H,14-16H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393395
PNG
(3-((3'-Methoxy-[1,1'-biphenyl]-4-yl)methoxy)-3-phe...)
Show SMILES COc1cccc(c1)-c1ccc(COC2(CN(C2)C#N)c2ccccc2)cc1
Show InChI InChI=1S/C24H22N2O2/c1-27-23-9-5-6-21(14-23)20-12-10-19(11-13-20)15-28-24(16-26(17-24)18-25)22-7-3-2-4-8-22/h2-14H,15-17H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393399
PNG
(3-((3'-Methoxy-[1,1'-biphenyl]-4-yl)(phenyl)methox...)
Show SMILES COc1cccc(c1)-c1ccc(cc1)C(OC1CN(C1)C#N)c1ccccc1
Show InChI InChI=1S/C24H22N2O2/c1-27-22-9-5-8-21(14-22)18-10-12-20(13-11-18)24(19-6-3-2-4-7-19)28-23-15-26(16-23)17-25/h2-14,23-24H,15-16H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393336
PNG
(5-(3-Fluoro-4-(((1S,3S)-3-isothiocyanatocyclobutox...)
Show SMILES Fc1cc(ccc1CO[C@H]1C[C@H](C1)N=C=S)-c1ccc2OCOc2c1
Show InChI InChI=1S/C19H16FNO3S/c20-17-5-12(13-3-4-18-19(6-13)24-11-23-18)1-2-14(17)9-22-16-7-15(8-16)21-10-25/h1-6,15-16H,7-9,11H2/t15-,16+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393337
PNG
(3-Fluoro-4-(((1S,3S)-3-isothiocyanatocyclobutoxy)m...)
Show SMILES COc1ccc(cc1OC)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C20H20FNO3S/c1-23-19-6-5-14(8-20(19)24-2)13-3-4-15(18(21)7-13)11-25-17-9-16(10-17)22-12-26/h3-8,16-17H,9-11H2,1-2H3/t16-,17+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393339
PNG
(5-(3-Fluoro-4-methoxyphenyl)-2-(((1R,3R)-3-isothio...)
Show SMILES COc1ccc(cc1F)-c1ccc(COC2C[C@@H](C2)N=C=S)nc1
Show InChI InChI=1S/C18H17FN2O2S/c1-22-18-5-3-12(6-17(18)19)13-2-4-14(20-9-13)10-23-16-7-15(8-16)21-11-24/h2-6,9,15-16H,7-8,10H2,1H3/t15-,16?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393346
PNG
(3'-(Benzyloxy)-3-fluoro-4-(((1R,3R)-3-isothiocyana...)
Show SMILES Fc1cc(ccc1COC1C[C@@H](C1)N=C=S)-c1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C25H22FNO2S/c26-25-12-20(9-10-21(25)16-29-24-13-22(14-24)27-17-30)19-7-4-8-23(11-19)28-15-18-5-2-1-3-6-18/h1-12,22,24H,13-16H2/t22-,24?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393370
PNG
(3-((3',5'-Bis(trifluoromethyl)-[1,1'-biphenyl]-4-y...)
Show SMILES FC(F)(F)c1cc(cc(c1)C(F)(F)F)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C19H14F6N2O/c20-18(21,22)15-5-14(6-16(7-15)19(23,24)25)13-3-1-12(2-4-13)10-28-17-8-27(9-17)11-26/h1-7,17H,8-10H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393373
PNG
(3-((4-(2-Methoxypyridin-3-yl)benzyl)oxy)azetidine-...)
Show SMILES COc1ncccc1-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C17H17N3O2/c1-21-17-16(3-2-8-19-17)14-6-4-13(5-7-14)11-22-15-9-20(10-15)12-18/h2-8,15H,9-11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393375
PNG
(3-((4'-Methyl-[1,1'-biphenyl]-4-yl)methoxy)azetidi...)
Show SMILES Cc1ccc(cc1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C18H18N2O/c1-14-2-6-16(7-3-14)17-8-4-15(5-9-17)12-21-18-10-20(11-18)13-19/h2-9,18H,10-12H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393379
PNG
(3-((3,3'-Dimethoxy-[1,1'-biphenyl]-4-yl)methoxy)az...)
Show SMILES COc1cccc(c1)-c1ccc(COC2CN(C2)C#N)c(OC)c1
Show InChI InChI=1S/C19H20N2O3/c1-22-17-5-3-4-14(8-17)15-6-7-16(19(9-15)23-2)12-24-18-10-21(11-18)13-20/h3-9,18H,10-12H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393393
PNG
(3-((4-(Bis(4-fluorophenyl)methoxy)-2-bromobenzyl)o...)
Show SMILES Fc1ccc(cc1)C(Oc1ccc(COC2CN(C2)C#N)c(Br)c1)c1ccc(F)cc1
Show InChI InChI=1S/C24H19BrF2N2O2/c25-23-11-21(10-5-18(23)14-30-22-12-29(13-22)15-28)31-24(16-1-6-19(26)7-2-16)17-3-8-20(27)9-4-17/h1-11,22,24H,12-14H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393404
PNG
((R)-3-([1,1'-biphenyl]-4-ylmethoxy)pyrrolidine-1-c...)
Show SMILES N#CN1CC[C@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H18N2O/c19-14-20-11-10-18(12-20)21-13-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-9,18H,10-13H2/t18-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393362
PNG
(US9963444, Example 63 | rrr)
Show SMILES COc1ccc(cc1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C18H18N2O2/c1-21-17-8-6-16(7-9-17)15-4-2-14(3-5-15)12-22-18-10-20(11-18)13-19/h2-9,18H,10-12H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393376
PNG
(3-((4'-Fluoro-[1,1'-biphenyl]-4-yl)methoxy)azetidi...)
Show SMILES Fc1ccc(cc1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C17H15FN2O/c18-16-7-5-15(6-8-16)14-3-1-13(2-4-14)11-21-17-9-20(10-17)12-19/h1-8,17H,9-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393382
PNG
(US9963444, Example 83 | rrr)
Show SMILES COc1cccc(OC)c1-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C19H20N2O3/c1-22-17-4-3-5-18(23-2)19(17)15-8-6-14(7-9-15)12-24-16-10-21(11-16)13-20/h3-9,16H,10-12H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393388
PNG
(3-((3'-Methoxy-5-phenoxy-[1,1'-biphenyl]-2-yl)meth...)
Show SMILES COc1cccc(c1)-c1cc(Oc2ccccc2)ccc1COC1CN(C1)C#N
Show InChI InChI=1S/C24H22N2O3/c1-27-21-9-5-6-18(12-21)24-13-22(29-20-7-3-2-4-8-20)11-10-19(24)16-28-23-14-26(15-23)17-25/h2-13,23H,14-16H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393397
PNG
(3-((4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)benzyl)...)
Show SMILES N#CN1CC(C1)(OCc1ccc(cc1)-c1ccc2OCCOc2c1)c1ccccc1
Show InChI InChI=1S/C25H22N2O3/c26-18-27-16-25(17-27,22-4-2-1-3-5-22)30-15-19-6-8-20(9-7-19)21-10-11-23-24(14-21)29-13-12-28-23/h1-11,14H,12-13,15-17H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393398
PNG
(US9963444, Example 99 | rrr)
Show SMILES Brc1ccc(cc1)C(OC1CN(C1)C#N)c1ccccc1
Show InChI InChI=1S/C17H15BrN2O/c18-15-8-6-14(7-9-15)17(13-4-2-1-3-5-13)21-16-10-20(11-16)12-19/h1-9,16-17H,10-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393316
PNG
(4-(10-Isothiocyanatodecyl)pyridine | US9963444, Ex...)
Show SMILES S=C=NCCCCCCCCCCc1ccncc1
Show InChI InChI=1S/C16H24N2S/c19-15-18-12-8-6-4-2-1-3-5-7-9-16-10-13-17-14-11-16/h10-11,13-14H,1-9,12H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393322
PNG
(4-((3-Isothiocyanatopropoxy)methyl)-1,1'-biphenyl ...)
Show SMILES S=C=NCCCOCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C17H17NOS/c20-14-18-11-4-12-19-13-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10H,4,11-13H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393324
PNG
(US9963444, Example 27 | rrr)
Show SMILES S=C=NCCCCCN1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C18H26N2S/c21-16-19-11-5-2-6-12-20-13-9-18(10-14-20)15-17-7-3-1-4-8-17/h1,3-4,7-8,18H,2,5-6,9-15H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393345
PNG
(3-Fluoro-4-(((1R,3R)-3-isothiocyanatocyclobutoxy)m...)
Show SMILES Fc1cc(ccc1COC1C[C@@H](C1)N=C=S)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C19H15F4NOS/c20-18-7-13(12-2-1-3-15(6-12)19(21,22)23)4-5-14(18)10-25-17-8-16(9-17)24-11-26/h1-7,16-17H,8-10H2/t16-,17?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393368
PNG
(3-((2',3'-Dimethoxy-[1,1'-biphenyl]-4-yl)methoxy)a...)
Show SMILES COc1cccc(-c2ccc(COC3CN(C3)C#N)cc2)c1OC
Show InChI InChI=1S/C19H20N2O3/c1-22-18-5-3-4-17(19(18)23-2)15-8-6-14(7-9-15)12-24-16-10-21(11-16)13-20/h3-9,16H,10-12H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393385
PNG
(US9963444, Example 86 | rrr)
Show SMILES N#CN1CC(COCc2ccc(cc2)-c2ccccc2)C1
Show InChI InChI=1S/C18H18N2O/c19-14-20-10-16(11-20)13-21-12-15-6-8-18(9-7-15)17-4-2-1-3-5-17/h1-9,16H,10-13H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393389
PNG
(3-((4'-Methoxy-5-phenoxy-[1,1'-biphenyl]-2-yl)meth...)
Show SMILES COc1ccc(cc1)-c1cc(Oc2ccccc2)ccc1COC1CN(C1)C#N
Show InChI InChI=1S/C24H22N2O3/c1-27-20-10-7-18(8-11-20)24-13-22(29-21-5-3-2-4-6-21)12-9-19(24)16-28-23-14-26(15-23)17-25/h2-13,23H,14-16H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393396
PNG
(3-((4-(Benzo[d][1,3]dioxol-5-yl)benzyl)oxy)-3-phen...)
Show SMILES N#CN1CC(C1)(OCc1ccc(cc1)-c1ccc2OCOc2c1)c1ccccc1
Show InChI InChI=1S/C24H20N2O3/c25-16-26-14-24(15-26,21-4-2-1-3-5-21)29-13-18-6-8-19(9-7-18)20-10-11-22-23(12-20)28-17-27-22/h1-12H,13-15,17H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393321
PNG
(3-((3-Isothiocyanatopropoxy)methyl)-1,1'-biphenyl ...)
Show SMILES S=C=NCCCOCc1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C17H17NOS/c20-14-18-10-5-11-19-13-15-6-4-9-17(12-15)16-7-2-1-3-8-16/h1-4,6-9,12H,5,10-11,13H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393323
PNG
(1((3-Isothiocyanatopropoxy)methyl)-4-phenoxybenzen...)
Show SMILES S=C=NCCCOCc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C17H17NO2S/c21-14-18-11-4-12-19-13-15-7-9-17(10-8-15)20-16-5-2-1-3-6-16/h1-3,5-10H,4,11-13H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393332
PNG
(4'-(((1S,3S)-3-isothiocyanatocyclobutoxy)methyl)-3...)
Show SMILES COc1cccc(c1)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)cc1
Show InChI InChI=1S/C19H19NO2S/c1-21-18-4-2-3-16(9-18)15-7-5-14(6-8-15)12-22-19-10-17(11-19)20-13-23/h2-9,17,19H,10-12H2,1H3/t17-,19+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393364
PNG
(3-((2',4'-Dimethoxy-[1,1'-biphenyl]-4-yl)methoxy)a...)
Show SMILES COc1ccc(c(OC)c1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C19H20N2O3/c1-22-16-7-8-18(19(9-16)23-2)15-5-3-14(4-6-15)12-24-17-10-21(11-17)13-20/h3-9,17H,10-12H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393380
PNG
(3-((4-Phenoxybenzyl)oxy)azetidine-1-carbonitrile |...)
Show SMILES N#CN1CC(C1)OCc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C17H16N2O2/c18-13-19-10-17(11-19)20-12-14-6-8-16(9-7-14)21-15-4-2-1-3-5-15/h1-9,17H,10-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393383
PNG
(US9963444, Example 84 | rrr)
Show SMILES N#CN1CC(C1)OCc1ccc(cc1)-c1ccc2OCCOc2c1
Show InChI InChI=1S/C19H18N2O3/c20-13-21-10-17(11-21)24-12-14-1-3-15(4-2-14)16-5-6-18-19(9-16)23-8-7-22-18/h1-6,9,17H,7-8,10-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393402
PNG
(US9963444, Example 103 | rrr)
Show SMILES CN(Cc1ccc(cc1)-c1ccccc1)C1CN(C1)C#N
Show InChI InChI=1S/C18H19N3/c1-20(18-12-21(13-18)14-19)11-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,18H,11-13H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393318
PNG
((11-Isothiocyanatoundecyl)benzene | US9963444, Exa...)
Show SMILES S=C=NCCCCCCCCCCCc1ccccc1
Show InChI InChI=1S/C18H27NS/c20-17-19-16-12-7-5-3-1-2-4-6-9-13-18-14-10-8-11-15-18/h8,10-11,14-15H,1-7,9,12-13,16H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393319
PNG
((9-Isothiocyanatononyl)benzene | US9963444, Exampl...)
Show SMILES S=C=NCCCCCCCCCc1ccccc1
Show InChI InChI=1S/C16H23NS/c18-15-17-14-10-5-3-1-2-4-7-11-16-12-8-6-9-13-16/h6,8-9,12-13H,1-5,7,10-11,14H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393330
PNG
(3,3'-Difluoro-4-(((1S,3S)-3-isothiocyanatocyclobut...)
Show SMILES COc1ccc(cc1F)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C19H17F2NO2S/c1-23-19-5-4-13(7-18(19)21)12-2-3-14(17(20)6-12)10-24-16-8-15(9-16)22-11-25/h2-7,15-16H,8-10H2,1H3/t15-,16+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393333
PNG
(4-Ethoxy-3,3'-difluoro-4'-(((1S,3S)-3-isothiocyana...)
Show SMILES CCOc1ccc(cc1F)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C20H19F2NO2S/c1-2-24-20-6-5-14(8-19(20)22)13-3-4-15(18(21)7-13)11-25-17-9-16(10-17)23-12-26/h3-8,16-17H,2,9-11H2,1H3/t16-,17+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393349
PNG
(3-Fluoro-4'-((1R,3R)-3-isothiocyanatocyclobutoxy)-...)
Show SMILES COc1ccc(cc1F)-c1ccc(O[C@H]2C[C@@H](C2)N=C=S)cc1
Show InChI InChI=1S/C18H16FNO2S/c1-21-18-7-4-13(8-17(18)19)12-2-5-15(6-3-12)22-16-9-14(10-16)20-11-23/h2-8,14,16H,9-10H2,1H3/t14-,16-
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393367
PNG
(3-((2',5'-Dimethoxy-[1,1'-biphenyl]-4-yl)methoxy)a...)
Show SMILES COc1ccc(OC)c(c1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C19H20N2O3/c1-22-16-7-8-19(23-2)18(9-16)15-5-3-14(4-6-15)12-24-17-10-21(11-17)13-20/h3-9,17H,10-12H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393372
PNG
(3-((4-(6-Methoxypyridin-3-yl)benzyl)oxy)azetidine-...)
Show SMILES COc1ccc(cn1)-c1ccc(COC2CN(C2)C#N)cc1
Show InChI InChI=1S/C17H17N3O2/c1-21-17-7-6-15(8-19-17)14-4-2-13(3-5-14)11-22-16-9-20(10-16)12-18/h2-8,16H,9-11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393377
PNG
(3-((3-Fluoro-3'-methoxy-[1,1'-biphenyl]-4-yl)metho...)
Show SMILES COc1cccc(c1)-c1ccc(COC2CN(C2)C#N)c(F)c1
Show InChI InChI=1S/C18H17FN2O2/c1-22-16-4-2-3-13(7-16)14-5-6-15(18(19)8-14)11-23-17-9-21(10-17)12-20/h2-8,17H,9-11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393394
PNG
(US9963444, Example 95 | rrr)
Show SMILES COc1cccc(c1)-c1ccc(COC2(C)CN(C2)C#N)cc1
Show InChI InChI=1S/C19H20N2O2/c1-19(12-21(13-19)14-20)23-11-15-6-8-16(9-7-15)17-4-3-5-18(10-17)22-2/h3-10H,11-13H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393400
PNG
(3-((4-(3,5-Dimethylisoxazol-4-yl)phenyl)(phenyl)me...)
Show SMILES Cc1noc(C)c1-c1ccc(cc1)C(OC1CN(C1)C#N)c1ccccc1
Show InChI InChI=1S/C22H21N3O2/c1-15-21(16(2)27-24-15)17-8-10-19(11-9-17)22(18-6-4-3-5-7-18)26-20-12-25(13-20)14-23/h3-11,20,22H,12-13H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393317
PNG
(2-(10-Isothiocyanatodecyl)pyrimidine | US9963444, ...)
Show SMILES S=C=NCCCCCCCCCCc1ncccn1
Show InChI InChI=1S/C15H23N3S/c19-14-16-11-8-6-4-2-1-3-5-7-10-15-17-12-9-13-18-15/h9,12-13H,1-8,10-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393320
PNG
(US9963444, Example 23 | rrr)
Show SMILES S=C=NCCOCCOCCOCc1ccccc1
Show InChI InChI=1S/C14H19NO3S/c19-13-15-6-7-16-8-9-17-10-11-18-12-14-4-2-1-3-5-14/h1-5H,6-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393326
PNG
(4-(((1S,3S)-3-Isothiocyanatocyclobutoxy)methyl)-4'...)
Show SMILES Cc1ccc(cc1)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)cc1
Show InChI InChI=1S/C19H19NOS/c1-14-2-6-16(7-3-14)17-8-4-15(5-9-17)12-21-19-10-18(11-19)20-13-22/h2-9,18-19H,10-12H2,1H3/t18-,19+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393365
PNG
(3-([1,1'-Biphenyl]-3-ylmethoxy)azetidine-1-carboni...)
Show SMILES N#CN1CC(C1)OCc1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C17H16N2O/c18-13-19-10-17(11-19)20-12-14-5-4-8-16(9-14)15-6-2-1-3-7-15/h1-9,17H,10-12H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393371
PNG
(3-((4-(Pyridin-3-yl)benzyl)oxy)azetidine-1-carboni...)
Show SMILES N#CN1CC(C1)OCc1ccc(cc1)-c1cccnc1
Show InChI InChI=1S/C16H15N3O/c17-12-19-9-16(10-19)20-11-13-3-5-14(6-4-13)15-2-1-7-18-8-15/h1-8,16H,9-11H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393378
PNG
(3-((3'-Methoxy-3-(trifluoromethyl)-[1,1'-biphenyl]...)
Show SMILES COc1cccc(c1)-c1ccc(COC2CN(C2)C#N)c(c1)C(F)(F)F
Show InChI InChI=1S/C19H17F3N2O2/c1-25-16-4-2-3-13(7-16)14-5-6-15(18(8-14)19(20,21)22)11-26-17-9-24(10-17)12-23/h2-8,17H,9-11H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393381
PNG
(3-((1-(3'-Methoxy-[1,1'-biphenyl]-4-yl)cyclopropyl...)
Show SMILES COc1cccc(c1)-c1ccc(cc1)C1(COC2CN(C2)C#N)CC1
Show InChI InChI=1S/C21H22N2O2/c1-24-19-4-2-3-17(11-19)16-5-7-18(8-6-16)21(9-10-21)14-25-20-12-23(13-20)15-22/h2-8,11,20H,9-10,12-14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393325
PNG
(4-(((1R,3R)-3-Isothiocyanatocyclobutoxy)methyl)-4'...)
Show SMILES Cc1ccc(cc1)-c1ccc(CO[C@H]2C[C@@H](C2)N=C=S)cc1
Show InChI InChI=1S/C19H19NOS/c1-14-2-6-16(7-3-14)17-8-4-15(5-9-17)12-21-19-10-18(11-19)20-13-22/h2-9,18-19H,10-12H2,1H3/t18-,19-
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393347
PNG
(US9963444, Example 49 | rrr)
Show SMILES Brc1cc(Oc2ccccc2)ccc1CO[C@H]1C[C@H](C1)N=C=S
Show InChI InChI=1S/C18H16BrNO2S/c19-18-10-16(22-15-4-2-1-3-5-15)7-6-13(18)11-21-17-8-14(9-17)20-12-23/h1-7,10,14,17H,8-9,11H2/t14-,17+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393403
PNG
((S)-3-([1,1'-Biphenyl]-4-ylmethoxy)pyrrolidine-1-c...)
Show SMILES N#CN1CC[C@@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H18N2O/c19-14-20-11-10-18(12-20)21-13-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-9,18H,10-13H2/t18-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393341
PNG
(4-Bromo-2-fluoro-1-(((1R,3R)-3-isothiocyanatocyclo...)
Show SMILES Fc1cc(Br)ccc1COC1C[C@@H](C1)N=C=S
Show InChI InChI=1S/C12H11BrFNOS/c13-9-2-1-8(12(14)3-9)6-16-11-4-10(5-11)15-7-17/h1-3,10-11H,4-6H2/t10-,11?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393355
PNG
((1R,3R)—N-(4-(benzo[d][1,3]dioxol-5-yl)benzyl...)
Show SMILES CCN(Cc1ccc(cc1)-c1ccc2OCOc2c1)C1C[C@@H](C1)N=C=S
Show InChI InChI=1S/C21H22N2O2S/c1-2-23(19-10-18(11-19)22-13-26)12-15-3-5-16(6-4-15)17-7-8-20-21(9-17)25-14-24-20/h3-9,18-19H,2,10-12,14H2,1H3/t18-,19?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393334
PNG
(3,3'-Difluoro-4-isopropoxy-4'-(((1S,3S)-3-isothioc...)
Show SMILES CC(C)Oc1ccc(cc1F)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C21H21F2NO2S/c1-13(2)26-21-6-5-15(8-20(21)23)14-3-4-16(19(22)7-14)11-25-18-9-17(10-18)24-12-27/h3-8,13,17-18H,9-11H2,1-2H3/t17-,18+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393329
PNG
(US9963444, Example 32 | rrr)
Show SMILES Fc1ccc(cc1)-c1ccc(CO[C@H]2C[C@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C18H15F2NOS/c19-15-5-3-12(4-6-15)13-1-2-14(18(20)7-13)10-22-17-8-16(9-17)21-11-23/h1-7,16-17H,8-10H2/t16-,17+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393356
PNG
(US9963444, Example 57 | rrr)
Show SMILES S=C=NC[C@H]1C[C@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C19H19NOS/c22-14-20-12-16-10-19(11-16)21-13-15-6-8-18(9-7-15)17-4-2-1-3-5-17/h1-9,16,19H,10-13H2/t16-,19+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393358
PNG
(3-Fluoro-4'-((((1r,4r)-4-isothiocyanatocyclohexyl)...)
Show SMILES COc1ccc(cc1F)-c1ccc(COC2CC[C@@H](CC2)N=C=S)cc1
Show InChI InChI=1S/C21H22FNO2S/c1-24-21-11-6-17(12-20(21)22)16-4-2-15(3-5-16)13-25-19-9-7-18(8-10-19)23-14-26/h2-6,11-12,18-19H,7-10,13H2,1H3/t18-,19?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393414
PNG
(US9963444, Example 115 | rrr)
Show SMILES N#Cc1ncc(OCCCCCCc2ccccc2)cn1
Show InChI InChI=1S/C17H19N3O/c18-12-17-19-13-16(14-20-17)21-11-7-2-1-4-8-15-9-5-3-6-10-15/h3,5-6,9-10,13-14H,1-2,4,7-8,11H2
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393338
PNG
(3-(3-Fluoro-4-(((1R,3R)-3-isothiocyanatocyclobutox...)
Show SMILES COc1ncccc1-c1ccc(COC2C[C@@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C18H17FN2O2S/c1-22-18-16(3-2-6-20-18)12-4-5-13(17(19)7-12)10-23-15-8-14(9-15)21-11-24/h2-7,14-15H,8-10H2,1H3/t14-,15?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393328
PNG
(US9963444, Example 31 | rrr)
Show SMILES S=C=N[C@@H]1C[C@@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H17NOS/c21-13-19-17-10-18(11-17)20-12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17-18H,10-12H2/t17-,18+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393344
PNG
(4-(3-Fluoro-4-(((1R,3R)-3-isothiocyanatocyclobutox...)
Show SMILES Cn1cc(cn1)-c1ccc(COC2C[C@@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C16H16FN3OS/c1-20-8-13(7-19-20)11-2-3-12(16(17)4-11)9-21-15-5-14(6-15)18-10-22/h2-4,7-8,14-15H,5-6,9H2,1H3/t14-,15?
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393305
PNG
(4-(4-Isothiocyanatobenzyl)pyridine | US9963444, Ex...)
Show SMILES S=C=Nc1ccc(Cc2ccncc2)cc1
Show InChI InChI=1S/C13H10N2S/c16-10-15-13-3-1-11(2-4-13)9-12-5-7-14-8-6-12/h1-8H,9H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393306
PNG
(1-Isothiocyanato-2-(4-benzylpiperazino)ethane | US...)
Show SMILES S=C=NCCN1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C14H19N3S/c18-13-15-6-7-16-8-10-17(11-9-16)12-14-4-2-1-3-5-14/h1-5H,6-12H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393353
PNG
((1S,3S)—N-([1,1'-biphenyl]-4-ylmethyl)-3-isot...)
Show SMILES CN(Cc1ccc(cc1)-c1ccccc1)C1C[C@@H](C1)N=C=S
Show InChI InChI=1S/C19H20N2S/c1-21(19-11-18(12-19)20-14-22)13-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,18-19H,11-13H2,1H3/t18-,19?
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393360
PNG
(US9963444, Example 61 | rrr)
Show SMILES FC(F)(F)c1cccc(c1)-c1ccc(CO[C@H]2Cc3ccccc3[C@H]2N=C=S)cc1
Show InChI InChI=1S/C24H18F3NOS/c25-24(26,27)20-6-3-5-18(12-20)17-10-8-16(9-11-17)14-29-22-13-19-4-1-2-7-21(19)23(22)28-15-30/h1-12,22-23H,13-14H2/t22-,23+/m0/s1
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393361
PNG
((1S,2R)-2-((3'-fluoro-4'-methoxy-[1,1'-biphenyl]-4...)
Show SMILES COc1ccc(cc1F)-c1ccc(CO[C@@H]2Cc3ccccc3[C@@H]2N=C=S)cc1
Show InChI InChI=1S/C24H20FNO2S/c1-27-22-11-10-18(12-21(22)25)17-8-6-16(7-9-17)14-28-23-13-19-4-2-3-5-20(19)24(23)26-15-29/h2-12,23-24H,13-14H2,1H3/t23-,24+/m1/s1
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393406
PNG
(US9963444, Example 107 | rrr)
Show SMILES N#C[C@H]1C[C@@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H17NO/c19-12-15-10-18(11-15)20-13-14-6-8-17(9-7-14)16-4-2-1-3-5-16/h1-9,15,18H,10-11,13H2/t15-,18-
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393407
PNG
((1S,3S)-3-([1,1'-biphenyl]-4-ylmethoxy)cyclobutane...)
Show SMILES N#C[C@@H]1C[C@@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H17NO/c19-12-15-10-18(11-15)20-13-14-6-8-17(9-7-14)16-4-2-1-3-5-16/h1-9,15,18H,10-11,13H2/t15-,18+
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393409
PNG
(5-((2-Bromo-4-phenoxybenzyl)oxy)picolinonitrile | ...)
Show SMILES Brc1cc(Oc2ccccc2)ccc1COc1ccc(nc1)C#N
Show InChI InChI=1S/C19H13BrN2O2/c20-19-10-17(24-16-4-2-1-3-5-16)8-6-14(19)13-23-18-9-7-15(11-21)22-12-18/h1-10,12H,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393410
PNG
(5-([1,1'-Biphenyl]-4-ylmethoxy)picolinonitrile | U...)
Show SMILES N#Cc1ccc(OCc2ccc(cc2)-c2ccccc2)cn1
Show InChI InChI=1S/C19H14N2O/c20-12-18-10-11-19(13-21-18)22-14-15-6-8-17(9-7-15)16-4-2-1-3-5-16/h1-11,13H,14H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393303
PNG
(N-(2-isothiocyanatoethyl)palmitamide | US9963444, ...)
Show SMILES CCCCCCCCCCCCCCCC(=O)NCCN=C=S
Show InChI InChI=1S/C19H36N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)21-17-16-20-18-23/h2-17H2,1H3,(H,21,22)
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393309
PNG
(4-(Morpholinomethyl)benzylisothiocyanate | US99634...)
Show SMILES S=C=NCc1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C13H16N2OS/c17-11-14-9-12-1-3-13(4-2-12)10-15-5-7-16-8-6-15/h1-4H,5-10H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393354
PNG
((1R,3R)—N-(4-(benzo[d][1,3]dioxol-5-yl)benzyl...)
Show SMILES CN(Cc1ccc(cc1)-c1ccc2OCOc2c1)C1C[C@@H](C1)N=C=S
Show InChI InChI=1S/C20H20N2O2S/c1-22(18-9-17(10-18)21-12-25)11-14-2-4-15(5-3-14)16-6-7-19-20(8-16)24-13-23-19/h2-8,17-18H,9-11,13H2,1H3/t17-,18?
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393405
PNG
(4-(4-Bromophenoxy)piperidine-1-carbonitrile | US99...)
Show SMILES Brc1ccc(OC2CCN(CC2)C#N)cc1
Show InChI InChI=1S/C12H13BrN2O/c13-10-1-3-11(4-2-10)16-12-5-7-15(9-14)8-6-12/h1-4,12H,5-8H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393415
PNG
(5-((5-phenylpentyl)oxy)pyrimidine-2-carbonitrile |...)
Show SMILES N#Cc1ncc(OCCCCCc2ccccc2)cn1
Show InChI InChI=1S/C16H17N3O/c17-11-16-18-12-15(13-19-16)20-10-6-2-5-9-14-7-3-1-4-8-14/h1,3-4,7-8,12-13H,2,5-6,9-10H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393351
PNG
((1R,3R)—N-([1,1'-Biphenyl]-4-ylmethyl)-3-isot...)
Show SMILES CN(Cc1ccc(cc1)-c1ccccc1)C1C[C@@H](C1)N=C=S
Show InChI InChI=1S/C19H20N2S/c1-21(19-11-18(12-19)20-14-22)13-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-10,18-19H,11-13H2,1H3/t18-,19?
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393411
PNG
(5-([1,1'-Biphenyl]-4-ylmethoxy)-3-fluoropicolinoni...)
Show SMILES Fc1cc(OCc2ccc(cc2)-c2ccccc2)cnc1C#N
Show InChI InChI=1S/C19H13FN2O/c20-18-10-17(12-22-19(18)11-21)23-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-10,12H,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393416
PNG
(5-(2-(2-(benzyloxy)ethoxy)ethoxy)pyrimidine-2-carb...)
Show SMILES N#Cc1ncc(OCCOCCOCc2ccccc2)cn1
Show InChI InChI=1S/C16H17N3O3/c17-10-16-18-11-15(12-19-16)22-9-8-20-6-7-21-13-14-4-2-1-3-5-14/h1-5,11-12H,6-9,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393310
PNG
(Benzyl 4-(isothiocyanatomethyl)tetrahydro-1(2H)-py...)
Show SMILES O=C(OCc1ccccc1)N1CCC(CN=C=S)CC1
Show InChI InChI=1S/C15H18N2O2S/c18-15(19-11-14-4-2-1-3-5-14)17-8-6-13(7-9-17)10-16-12-20/h1-5,13H,6-11H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393327
PNG
(4-(((1R,3R)-3-isothiocyanatocyclobutoxy)methyl)-1,...)
Show SMILES S=C=N[C@H]1C[C@@H](C1)OCc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H17NOS/c21-13-19-17-10-18(11-17)20-12-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-9,17-18H,10-12H2/t17-,18-
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393359
PNG
(1-Bromo-4-((((1R,3R)-3-isothiocyanatocyclopentyl)o...)
Show SMILES Brc1ccc(CO[C@@H]2CC[C@H](C2)N=C=S)cc1
Show InChI InChI=1S/C13H14BrNOS/c14-11-3-1-10(2-4-11)8-16-13-6-5-12(7-13)15-9-17/h1-4,12-13H,5-8H2/t12-,13-/m1/s1
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393408
PNG
(2-(3-((3'-Methoxy-[1,1'-biphenyl]-4-yl)methoxy)aze...)
Show SMILES COc1cccc(c1)-c1ccc(COC2CN(CC#N)C2)cc1
Show InChI InChI=1S/C19H20N2O2/c1-22-18-4-2-3-17(11-18)16-7-5-15(6-8-16)14-23-19-12-21(13-19)10-9-20/h2-8,11,19H,10,12-14H2,1H3
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM50073714
PNG
(PHENYLBUTYL ISOTHIOCYANATE | Phenylbutyl Isothiocy...)
Show SMILES S=C=NCCCCc1ccccc1
Show InChI InChI=1S/C11H13NS/c13-10-12-9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-9H2
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Patents


Similars

US Patent
n/an/a>1.00E+3n/an/an/an/an/an/a



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393299
PNG
((5-Isothiocyanatopentyl)benzene | US9963444, Examp...)
Show SMILES S=C=NCCCCCc1ccccc1
Show InChI InChI=1S/C12H15NS/c14-11-13-10-6-2-5-9-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-10H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393300
PNG
((8-Isothiocyanatooctyl)benzene | US9963444, Exampl...)
Show SMILES S=C=NCCCCCCCCc1ccccc1
Show InChI InChI=1S/C15H21NS/c17-14-16-13-9-4-2-1-3-6-10-15-11-7-5-8-12-15/h5,7-8,11-12H,1-4,6,9-10,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393302
PNG
(2-(7-Isothiocyanatoheptyl)naphthalene | US9963444,...)
Show SMILES S=C=NCCCCCCCc1ccc2ccccc2c1
Show InChI InChI=1S/C18H21NS/c20-15-19-13-7-3-1-2-4-8-16-11-12-17-9-5-6-10-18(17)14-16/h5-6,9-12,14H,1-4,7-8,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393307
PNG
(4-(4-(Isothiocyanatomethyl)phenyl)morpholine | US9...)
Show SMILES S=C=NCc1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C12H14N2OS/c16-10-13-9-11-1-3-12(4-2-11)14-5-7-15-8-6-14/h1-4H,5-9H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393308
PNG
(4-Benzyl-1-(2-isothiocyanatoethyl)piperidine | US9...)
Show SMILES S=C=NCCN1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C15H20N2S/c18-13-16-8-11-17-9-6-15(7-10-17)12-14-4-2-1-3-5-14/h1-5,15H,6-12H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393312
PNG
(1-(Isothiocyanatomethyl)-4-(phenoxymethyl)benzene ...)
Show SMILES S=C=NCc1ccc(COc2ccccc2)cc1
Show InChI InChI=1S/C15H13NOS/c18-12-16-10-13-6-8-14(9-7-13)11-17-15-4-2-1-3-5-15/h1-9H,10-11H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393313
PNG
(US9963444, Example 16 | rrr)
Show SMILES FC(F)(F)c1ccccc1CCCCCCCCCCN=C=S
Show InChI InChI=1S/C18H24F3NS/c19-18(20,21)17-13-9-8-12-16(17)11-7-5-3-1-2-4-6-10-14-22-15-23/h8-9,12-13H,1-7,10-11,14H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393331
PNG
(4'-(((1R,3R)-3-isothiocyanatocyclobutoxy)methyl)-3...)
Show SMILES COc1cccc(c1)-c1ccc(CO[C@H]2C[C@@H](C2)N=C=S)cc1
Show InChI InChI=1S/C19H19NO2S/c1-21-18-4-2-3-16(9-18)15-7-5-14(6-8-15)12-22-19-10-17(11-19)20-13-23/h2-9,17,19H,10-12H2,1H3/t17-,19-
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393357
PNG
(US9963444, Example 58 | rrr)
Show SMILES FC(F)(F)c1cccc(c1)-c1ccc(COC2CCCC(C2)N=C=S)cc1
Show InChI InChI=1S/C21H20F3NOS/c22-21(23,24)18-4-1-3-17(11-18)16-9-7-15(8-10-16)13-26-20-6-2-5-19(12-20)25-14-27/h1,3-4,7-11,19-20H,2,5-6,12-13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393412
PNG
(3-([1,1'-Biphenyl]-4-ylmethoxy)-5-fluoropicolinoni...)
Show SMILES Fc1cnc(C#N)c(OCc2ccc(cc2)-c2ccccc2)c1
Show InChI InChI=1S/C19H13FN2O/c20-17-10-19(18(11-21)22-12-17)23-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-10,12H,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393343
PNG
(4-(3-Fluoro-4-(((1R,3R)-3-isothiocyanatocyclobutox...)
Show SMILES Cc1noc(C)c1-c1ccc(COC2C[C@@H](C2)N=C=S)c(F)c1
Show InChI InChI=1S/C17H17FN2O2S/c1-10-17(11(2)22-20-10)12-3-4-13(16(18)5-12)8-21-15-6-14(7-15)19-9-23/h3-5,14-15H,6-8H2,1-2H3/t14-,15?
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393348
PNG
(US9963444, Example 50 | rrr)
Show SMILES S=C=N[C@@H]1C[C@@H](C1)OCc1ccc(Oc2ccccc2)cc1-c1ccccc1
Show InChI InChI=1S/C24H21NO2S/c28-17-25-20-13-23(14-20)26-16-19-11-12-22(27-21-9-5-2-6-10-21)15-24(19)18-7-3-1-4-8-18/h1-12,15,20,23H,13-14,16H2/t20-,23+
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393413
PNG
(US9963444, Example 114 | rrr)
Show SMILES O=C(OCCCCCc1ccccc1)c1cccc(n1)C#N
Show InChI InChI=1S/C18H18N2O2/c19-14-16-11-7-12-17(20-16)18(21)22-13-6-2-5-10-15-8-3-1-4-9-15/h1,3-4,7-9,11-12H,2,5-6,10,13H2
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393304
PNG
(N-(2-Isothiocyanatoethyl)-7-(naphthalene-2-yl)hept...)
Show SMILES O=C(CCCCCCc1ccc2ccccc2c1)NCCN=C=S
Show InChI InChI=1S/C20H24N2OS/c23-20(22-14-13-21-16-24)10-4-2-1-3-7-17-11-12-18-8-5-6-9-19(18)15-17/h5-6,8-9,11-12,15H,1-4,7,10,13-14H2,(H,22,23)
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393311
PNG
(2-(4-(Isothiocyanatomethyl)phenoxy)-6-methylpyrazi...)
Show SMILES Cc1cncc(Oc2ccc(CN=C=S)cc2)n1
Show InChI InChI=1S/C13H11N3OS/c1-10-6-14-8-13(16-10)17-12-4-2-11(3-5-12)7-15-9-18/h2-6,8H,7H2,1H3
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393314
PNG
(1-(10-Isothiocyanatodecyl)-4-methoxybenzene | US99...)
Show SMILES COc1ccc(CCCCCCCCCCN=C=S)cc1
Show InChI InChI=1S/C18H27NOS/c1-20-18-13-11-17(12-14-18)10-8-6-4-2-3-5-7-9-15-19-16-21/h11-14H,2-10,15H2,1H3
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
N-acylethanolamine-hydrolyzing acid amidase


(Homo sapiens (Human))
BDBM393340
PNG
(3,4'-Difluoro-3'-(((1S,3S)-3-isothiocyanatocyclobu...)
Show SMILES COc1ccc(cc1F)-c1ccc(F)c(CO[C@H]2C[C@H](C2)N=C=S)c1
Show InChI InChI=1S/C19H17F2NO2S/c1-23-19-5-3-13(7-18(19)21)12-2-4-17(20)14(6-12)10-24-16-8-15(9-16)22-11-25/h2-7,15-16H,8-10H2,1H3/t15-,16+
PDB

UniProtKB/SwissProt

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



Northeastern University

US Patent


Assay Description
In order to have an assay method more conducive to high-throughput screening than those published for measuring the NAE hydrolyzing activity of NAAA,...


US Patent US9963444 (2018)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%