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Compile Data Set for Download or QSAR

Found 27 hits with Last Name = 'nabergoj' and Initial = 's'   
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
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50164885
PNG
(CHEBI:59414 | muramyldipeptide)
Show SMILES C[C@H](NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O)[C@@H]1NC(C)=O)C(=O)N[C@H](CCC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C19H32N4O11/c1-7(17(30)23-10(16(20)29)4-5-12(26)27)21-18(31)8(2)33-15-13(22-9(3)25)19(32)34-11(6-24)14(15)28/h7-8,10-11,13-15,19,24,28,32H,4-6H2,1-3H3,(H2,20,29)(H,21,31)(H,22,25)(H,23,30)(H,26,27)/t7-,8+,10+,11+,13+,14+,15+,19+/m0/s1
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n/an/an/an/a 148n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582647
PNG
(CHEMBL5087802)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CCC(=O)OCC)C(=O)OCC)cc1OC |r|
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n/an/an/an/a 1.45E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582624
PNG
(CHEMBL5077981)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CCc1ccc(O)c(OC)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 6.16E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582625
PNG
(CHEMBL5088212)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CCCc1ccc(O)c(OC)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 1.39E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582626
PNG
(CHEMBL5084692)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(OC)c(OC)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 763n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582627
PNG
(CHEMBL5091511)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(O)c(O)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 1.73E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582628
PNG
(CHEMBL5082818)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(N)cc1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 542n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582629
PNG
(CHEMBL5090188)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(cc1)C(C)C)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 71n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582630
PNG
(CHEMBL5086803)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 49n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582631
PNG
(CHEMBL5079466)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C1CC1c1ccc(OC)c(OC)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 322n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582632
PNG
(CHEMBL5079980)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C1CC1c1ccc(O)c(OC)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 369n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50245039
PNG
(CHEMBL4069541)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C1CC1c1ccc(F)c(F)c1)C(C)C)C(=O)OCC |r|
Show InChI InChI=1S/C26H35F2N3O7/c1-5-37-22(33)10-9-20(26(36)38-6-2)30-25(35)23(14(3)4)31-21(32)13-29-24(34)17-12-16(17)15-7-8-18(27)19(28)11-15/h7-8,11,14,16-17,20,23H,5-6,9-10,12-13H2,1-4H3,(H,29,34)(H,30,35)(H,31,32)/t16?,17?,20-,23+/m1/s1
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n/an/an/an/a 49n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582633
PNG
(CHEMBL5075343)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 66n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582634
PNG
(CHEMBL5077049)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 39n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582635
PNG
(CHEMBL5077856)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@H](COCc1ccccc1)NC(=O)CNC(=O)\C=C\c1ccc(O)c(OC)c1)C(=O)OCC |r|
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n/an/an/an/a 5.56E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582636
PNG
(CHEMBL5091872)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)\C=C\c1ccc(O)c(OC)c1)C(=O)OCC |r|
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n/an/an/an/a>2.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582637
PNG
(CHEMBL5092451)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(O)c(OC)c1)[C@@H](C)O)C(=O)OCC |r|
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n/an/an/an/a 1.25E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582638
PNG
(CHEMBL5071126)
Show SMILES CCOC(=O)[C@@H](CCC(=O)NC(CCCCN)C(=O)OC)NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(O)c(OC)c1)C(C)C |r|
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n/an/an/an/a 1.02E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582639
PNG
(CHEMBL5090076)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)NCCCCC(NC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(O)c(OC)c1)C(C)C)C(=O)OCC)C(=O)OC |r|
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n/an/an/an/a 1.15E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582640
PNG
(CHEMBL5079672)
Show SMILES COc1cc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OC2CCCC2)C(=O)OC2CCCC2)ccc1O |r|
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n/an/an/an/a 40n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582641
PNG
(CHEMBL5085864)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(OC(C)=O)c(OC)c1)C(C)C)C(=O)OCC |r|
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n/an/an/an/a 62n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582642
PNG
(CHEMBL5070781)
Show SMILES CCCCCCCCCCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OCC)C(=O)OCC)cc1OC |r|
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n/an/an/an/a 30n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582643
PNG
(CHEMBL5076507)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OCC)C(=O)OCC)cc1OC |r|
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n/an/an/an/a 2.83E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582644
PNG
(CHEMBL5077437)
Show SMILES COc1cc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OC2CCCC2)C(=O)OC2CCCC2)ccc1OC(C)=O |r|
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n/an/an/an/a 63n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582645
PNG
(CHEMBL5073412)
Show SMILES CCCCCCCCCCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OC2CCCC2)C(=O)OC2CCCC2)cc1OC |r|
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UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 243n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50582646
PNG
(CHEMBL5069832)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)Oc1ccc(\C=C\C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCC(=O)OC2CCCC2)C(=O)OC2CCCC2)cc1OC |r|
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n/an/an/an/a 6.16E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 2


(Homo sapiens (Human))
BDBM50245040
PNG
(CHEMBL4090558)
Show SMILES CCOC(=O)CC[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)\C=C\c1ccc(O)c(OC)c1)C(C)C)C(=O)OCC |r|
Show InChI InChI=1S/C26H37N3O9/c1-6-37-23(33)13-10-18(26(35)38-7-2)28-25(34)24(16(3)4)29-22(32)15-27-21(31)12-9-17-8-11-19(30)20(14-17)36-5/h8-9,11-12,14,16,18,24,30H,6-7,10,13,15H2,1-5H3,(H,27,31)(H,28,34)(H,29,32)/b12-9+/t18-,24+/m1/s1
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Similars

Article
PubMed
n/an/an/an/a 89n/an/an/an/a


TBA

Assay Description
Agonist activity at NOD2 in HEK-Blue hNOD2 cells assessed as increase in NFkappaB transactivation-mediated SEAP activity measured after 18 hrs by spe...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00644
BindingDB Entry DOI: 10.7270/Q2W66QN7
More data for this
Ligand-Target Pair