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PubChem AID 488860

Compile data set for download or QSAR
Found 41 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
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM67953
PNG
(1-(3-chlorophenyl)-3-(1-phenyltetrazol-5-yl)sulfan...)
Show SMILES Oc1cc(Sc2nnnn2-c2ccccc2)c(O)n1-c1cccc(Cl)c1
Show InChI InChI=1S/C17H12ClN5O2S/c18-11-5-4-8-13(9-11)22-15(24)10-14(16(22)25)26-17-19-20-21-23(17)12-6-2-1-3-7-12/h1-10,24-25H
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n/an/a 5.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM64746
PNG
(3-[1-(2-chloranyl-6-fluoranyl-phenyl)-2-nitro-ethy...)
Show SMILES Cc1cc2ccccn2c1C(C[N+]([O-])=O)c1c(F)cccc1Cl
Show InChI InChI=1S/C17H14ClFN2O2/c1-11-9-12-5-2-3-8-20(12)17(11)13(10-21(22)23)16-14(18)6-4-7-15(16)19/h2-9,13H,10H2,1H3
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n/an/a 7.92E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76315
PNG
((E)-N'-(2-propoxyphenyl)-2-butenediamide | (E)-N'-...)
Show SMILES CCCOc1ccccc1NC(=O)\C=C\C(N)=O
Show InChI InChI=1S/C13H16N2O3/c1-2-9-18-11-6-4-3-5-10(11)15-13(17)8-7-12(14)16/h3-8H,2,9H2,1H3,(H2,14,16)(H,15,17)/b8-7+
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n/an/a 8.50E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM66466
PNG
((Z)-1,4-bis(4-methylphenyl)-2-butene-1,4-dione | (...)
Show SMILES Cc1ccc(cc1)C(=O)\C=C/C(=O)c1ccc(C)cc1
Show InChI InChI=1S/C18H16O2/c1-13-3-7-15(8-4-13)17(19)11-12-18(20)16-9-5-14(2)6-10-16/h3-12H,1-2H3/b12-11-
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n/an/a 8.75E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76309
PNG
(1-[6-(4-Fluoro-phenoxy)-hexyl]-4-(2-methoxy-phenyl...)
Show SMILES COc1ccccc1N1CCN(CCCCCCOc2ccc(F)cc2)CC1
Show InChI InChI=1S/C23H31FN2O2/c1-27-23-9-5-4-8-22(23)26-17-15-25(16-18-26)14-6-2-3-7-19-28-21-12-10-20(24)11-13-21/h4-5,8-13H,2-3,6-7,14-19H2,1H3
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n/an/a 9.66E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76331
PNG
(1-(3,6-dichloro-9-carbazolyl)-3-(1-piperidinyl)-2-...)
Show SMILES OC(CN1CCCCC1)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc12
Show InChI InChI=1S/C20H22Cl2N2O/c21-14-4-6-19-17(10-14)18-11-15(22)5-7-20(18)24(19)13-16(25)12-23-8-2-1-3-9-23/h4-7,10-11,16,25H,1-3,8-9,12-13H2
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n/an/a 1.02E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76310
PNG
(2-Phenyl-1-(4-propoxy-phenyl)-3-pyrrolidin-1-yl-pr...)
Show SMILES CCCOc1ccc(cc1)C(=O)C(CN1CCCC1)c1ccccc1
Show InChI InChI=1S/C22H27NO2/c1-2-16-25-20-12-10-19(11-13-20)22(24)21(17-23-14-6-7-15-23)18-8-4-3-5-9-18/h3-5,8-13,21H,2,6-7,14-17H2,1H3
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n/an/a 1.02E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM54734
PNG
((Z)-4-(3-nitroanilino)-4-oxo-2-butenoic acid methy...)
Show SMILES COC(=O)\C=C/C(=O)Nc1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C11H10N2O5/c1-18-11(15)6-5-10(14)12-8-3-2-4-9(7-8)13(16)17/h2-7H,1H3,(H,12,14)/b6-5-
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n/an/a 1.09E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76329
PNG
(2-methyl-N-(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)...)
Show SMILES CC(=C)C(=O)Nc1nnc(s1)-c1cccs1
Show InChI InChI=1S/C10H9N3OS2/c1-6(2)8(14)11-10-13-12-9(16-10)7-4-3-5-15-7/h3-5H,1H2,2H3,(H,11,13,14)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76320
PNG
(5-[chloranyl-[1-(4-methylphenyl)-1,2,3,4-tetrazol-...)
Show SMILES Cc1ccc(cc1)-n1nnnc1C(Cl)c1nnnn1-c1ccc(C)cc1
Show InChI InChI=1S/C17H15ClN8/c1-11-3-7-13(8-4-11)25-16(19-21-23-25)15(18)17-20-22-24-26(17)14-9-5-12(2)6-10-14/h3-10,15H,1-2H3
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n/an/a 1.10E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM61402
PNG
((Z)-2-butenedioic acid;2-(2,2-dicyclohexylethyl)pi...)
Show SMILES C(C(C1CCCCC1)C1CCCCC1)C1CCCCN1
Show InChI InChI=1S/C19H35N/c1-3-9-16(10-4-1)19(17-11-5-2-6-12-17)15-18-13-7-8-14-20-18/h16-20H,1-15H2
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n/an/a 1.29E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM50282105
PNG
(2-Hydroxy-N-(3-phenyl-propyl)-benzamide | CHEMBL29...)
Show SMILES Oc1ccccc1C(=O)NCCCc1ccccc1
Show InChI InChI=1S/C16H17NO2/c18-15-11-5-4-10-14(15)16(19)17-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11,18H,6,9,12H2,(H,17,19)
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n/an/a 1.31E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM61638
PNG
((E)-2-cyano-3-(5-nitro-2-furanyl)-N-(1-phenylethyl...)
Show SMILES CC(NC(=O)C(=C\c1ccc(o1)[N+]([O-])=O)\C#N)c1ccccc1
Show InChI InChI=1S/C16H13N3O4/c1-11(12-5-3-2-4-6-12)18-16(20)13(10-17)9-14-7-8-15(23-14)19(21)22/h2-9,11H,1H3,(H,18,20)/b13-9+
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n/an/a 1.43E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM54332
PNG
(4-[3-(4-aminophenoxy)phenoxy]aniline | 4-[3-(4-aza...)
Show SMILES Nc1ccc(Oc2cccc(Oc3ccc(N)cc3)c2)cc1
Show InChI InChI=1S/C18H16N2O2/c19-13-4-8-15(9-5-13)21-17-2-1-3-18(12-17)22-16-10-6-14(20)7-11-16/h1-12H,19-20H2
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n/an/a 1.53E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM42770
PNG
(3-[(5-methylthiophene-3-carbonyl)amino]thiophene-2...)
Show SMILES COC(=O)c1sccc1NC(=O)c1csc(C)c1
Show InChI InChI=1S/C12H11NO3S2/c1-7-5-8(6-18-7)11(14)13-9-3-4-17-10(9)12(15)16-2/h3-6H,1-2H3,(H,13,14)
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n/an/a 1.59E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76321
PNG
(3-chloranyl-N-[3-(dimethylamino)propyl]-N-(6-methy...)
Show SMILES CN(C)CCCN(C(=O)c1sc2ccccc2c1Cl)c1nc2ccc(C)cc2s1
Show InChI InChI=1S/C22H22ClN3OS2/c1-14-9-10-16-18(13-14)29-22(24-16)26(12-6-11-25(2)3)21(27)20-19(23)15-7-4-5-8-17(15)28-20/h4-5,7-10,13H,6,11-12H2,1-3H3
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n/an/a 1.69E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM66426
PNG
(1-(4,5-dimethyl-2-nitro-phenyl)-3-pyrroline-2,5-qu...)
Show SMILES Cc1cc(N2C(=O)C=CC2=O)c(cc1C)[N+]([O-])=O |c:7|
Show InChI InChI=1S/C12H10N2O4/c1-7-5-9(10(14(17)18)6-8(7)2)13-11(15)3-4-12(13)16/h3-6H,1-2H3
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n/an/a 1.77E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM68054
PNG
(5-(4-chlorophenyl)sulfonyl-1-methyl-4-nitro-imidaz...)
Show SMILES Cn1cnc(c1S(=O)(=O)c1ccc(Cl)cc1)[N+]([O-])=O
Show InChI InChI=1S/C10H8ClN3O4S/c1-13-6-12-9(14(15)16)10(13)19(17,18)8-4-2-7(11)3-5-8/h2-6H,1H3
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n/an/a 1.77E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76316
PNG
(2,4-bis(chloranyl)-N-(4-pyrrol-1-ylphenyl)benzenes...)
Show SMILES Clc1ccc(c(Cl)c1)S(=O)(=O)Nc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C16H12Cl2N2O2S/c17-12-3-8-16(15(18)11-12)23(21,22)19-13-4-6-14(7-5-13)20-9-1-2-10-20/h1-11,19H
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n/an/a 1.83E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM47714
PNG
((2Z)-3-ethyl-2-[(2E,4E)-5-(3-ethyl-1,3-benzothiazo...)
Show SMILES CCN1\C(Sc2ccccc12)=C\C=C\C=C\c1sc2ccccc2[n+]1CC
Show InChI InChI=1S/C23H23N2S2/c1-3-24-18-12-8-10-14-20(18)26-22(24)16-6-5-7-17-23-25(4-2)19-13-9-11-15-21(19)27-23/h5-17H,3-4H2,1-2H3/q+1
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n/an/a 1.95E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76314
PNG
(2-(4-isopropoxyanilino)-N-(p-tolyl)acetamide | MLS...)
Show SMILES CC(C)Oc1ccc(NCC(=O)Nc2ccc(C)cc2)cc1
Show InChI InChI=1S/C18H22N2O2/c1-13(2)22-17-10-8-15(9-11-17)19-12-18(21)20-16-6-4-14(3)5-7-16/h4-11,13,19H,12H2,1-3H3,(H,20,21)
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n/an/a 2.26E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76308
PNG
((5-methyl-2-pyridin-4-yl-1,3-thiazol-4-yl) benzoat...)
Show SMILES Cc1sc(nc1OC(=O)c1ccccc1)-c1ccncc1
Show InChI InChI=1S/C16H12N2O2S/c1-11-14(20-16(19)13-5-3-2-4-6-13)18-15(21-11)12-7-9-17-10-8-12/h2-10H,1H3
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n/an/a 2.31E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76330
PNG
(MLS000679904 | N-({2-[4-(pentanoylamino)benzoyl]hy...)
Show SMILES CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1ccco1
Show InChI InChI=1S/C18H20N4O4S/c1-2-3-6-15(23)19-13-9-7-12(8-10-13)16(24)21-22-18(27)20-17(25)14-5-4-11-26-14/h4-5,7-11H,2-3,6H2,1H3,(H,19,23)(H,21,24)(H2,20,22,25,27)
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n/an/a 2.57E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76319
PNG
((5Z)-3-(1,1-diketothiolan-3-yl)-5-(3-pyridylmethyl...)
Show SMILES O=C1N(C2CCS(=O)(=O)C2)C(=S)S\C1=C/c1cccnc1
Show InChI InChI=1S/C13H12N2O3S3/c16-12-11(6-9-2-1-4-14-7-9)20-13(19)15(12)10-3-5-21(17,18)8-10/h1-2,4,6-7,10H,3,5,8H2/b11-6-
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n/an/a 3.38E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76326
PNG
(MLS000390388 | N-(2,4-dichlorobenzyl)-4-ethyl-benz...)
Show SMILES CCc1ccc(cc1)C(=O)NCc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C16H15Cl2NO/c1-2-11-3-5-12(6-4-11)16(20)19-10-13-7-8-14(17)9-15(13)18/h3-9H,2,10H2,1H3,(H,19,20)
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n/an/a 3.39E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76318
PNG
(2-(2,5-Dioxo-1-p-tolyl-pyrrolidin-3-ylsulfanyl)-be...)
Show SMILES Cc1ccc(cc1)-n1c(O)cc(Sc2ccccc2C(O)=O)c1O
Show InChI InChI=1S/C18H15NO4S/c1-11-6-8-12(9-7-11)19-16(20)10-15(17(19)21)24-14-5-3-2-4-13(14)18(22)23/h2-10,20-21H,1H3,(H,22,23)
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n/an/a 3.44E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76312
PNG
(1-(4-acetylphenyl)-3-(4-chlorophenyl)urea | 1-(4-c...)
Show SMILES CC(=O)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C15H13ClN2O2/c1-10(19)11-2-6-13(7-3-11)17-15(20)18-14-8-4-12(16)5-9-14/h2-9H,1H3,(H2,17,18,20)
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n/an/a 3.59E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76322
PNG
(4-(1,3-benzothiazol-2-yl)-1-(4-o-phenetylpiperazin...)
Show SMILES CCOc1ccccc1N1CCN(CC1)C(=O)CCCc1nc2ccccc2s1
Show InChI InChI=1S/C23H27N3O2S/c1-2-28-20-10-5-4-9-19(20)25-14-16-26(17-15-25)23(27)13-7-12-22-24-18-8-3-6-11-21(18)29-22/h3-6,8-11H,2,7,12-17H2,1H3
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n/an/a 3.63E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76313
PNG
(4-(2,4-dichlorophenoxy)-N-isopropyl-butyramide | 4...)
Show SMILES CC(C)NC(=O)CCCOc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C13H17Cl2NO2/c1-9(2)16-13(17)4-3-7-18-12-6-5-10(14)8-11(12)15/h5-6,8-9H,3-4,7H2,1-2H3,(H,16,17)
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n/an/a 4.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76323
PNG
(2-(2-methoxyphenyl)-5-phenyl-3a,4,5,6,7,7a-hexahyd...)
Show SMILES COc1ccccc1-n1c(O)c2CCC(Cc2c1O)c1ccccc1 |(14.41,-3.93,;13.64,-2.59,;14.41,-1.26,;15.95,-1.26,;16.72,.08,;15.95,1.41,;14.41,1.41,;13.64,.08,;12.1,.08,;11.21,-1.16,;11.68,-2.63,;9.75,-.69,;8.41,-1.46,;7.08,-.69,;7.08,.85,;8.41,1.62,;9.75,.85,;11.21,1.31,;11.68,2.78,;5.75,1.62,;5.75,3.16,;4.41,3.93,;3.08,3.16,;3.08,1.62,;4.41,.85,)|
Show InChI InChI=1S/C21H21NO3/c1-25-19-10-6-5-9-18(19)22-20(23)16-12-11-15(13-17(16)21(22)24)14-7-3-2-4-8-14/h2-10,15,23-24H,11-13H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76317
PNG
(2-(4,5-dihydrobenzo[g][1]benzothiol-2-yl)-5-(methy...)
Show SMILES CSc1nnc(o1)-c1cc2CCc3ccccc3-c2s1
Show InChI InChI=1S/C15H12N2OS2/c1-19-15-17-16-14(18-15)12-8-10-7-6-9-4-2-3-5-11(9)13(10)20-12/h2-5,8H,6-7H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM42501
PNG
(1-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-N-...)
Show SMILES COc1cc(C=Nn2cnnc2)ccc1OCc1ccc(C)cc1 |w:6.6|
Show InChI InChI=1S/C18H18N4O2/c1-14-3-5-15(6-4-14)11-24-17-8-7-16(9-18(17)23-2)10-21-22-12-19-20-13-22/h3-10,12-13H,11H2,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76327
PNG
(4-[4-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)buty...)
Show SMILES Cc1cc(Cl)c(OCCCCN2CCOCC2)c(Br)c1
Show InChI InChI=1S/C15H21BrClNO2/c1-12-10-13(16)15(14(17)11-12)20-7-3-2-4-18-5-8-19-9-6-18/h10-11H,2-9H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76325
PNG
((3Z)-5-(3,4-dimethoxyphenyl)-3-(3-pyridinylmethyli...)
Show SMILES COc1ccc(cc1OC)C1=C\C(=C\c2cccnc2)C(=O)O1 |t:11|
Show InChI InChI=1S/C18H15NO4/c1-21-15-6-5-13(9-17(15)22-2)16-10-14(18(20)23-16)8-12-4-3-7-19-11-12/h3-11H,1-2H3/b14-8-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76324
PNG
(2-[3-(trifluoromethyl)anilino]-3-pyridinecarboxyli...)
Show SMILES CCN(C1CCS(=O)(=O)C1)C(=O)COC(=O)c1cccnc1Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C21H22F3N3O5S/c1-2-27(16-8-10-33(30,31)13-16)18(28)12-32-20(29)17-7-4-9-25-19(17)26-15-6-3-5-14(11-15)21(22,23)24/h3-7,9,11,16H,2,8,10,12-13H2,1H3,(H,25,26)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM33653
PNG
(1-[3-(4-chlorophenyl)-5-[(4-fluorobenzyl)amino]-1,...)
Show SMILES COCC(=O)n1nc(nc1NCc1ccc(F)cc1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C18H16ClFN4O2/c1-26-11-16(25)24-18(21-10-12-2-8-15(20)9-3-12)22-17(23-24)13-4-6-14(19)7-5-13/h2-9H,10-11H2,1H3,(H,21,22,23)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM52505
PNG
(1H-imidazo[4,5-b]phenazine | MLS000700045 | SMR000...)
Show SMILES c1nc2cc3nc4ccccc4nc3cc2[nH]1
Show InChI InChI=1S/C13H8N4/c1-2-4-9-8(3-1)16-12-5-10-11(15-7-14-10)6-13(12)17-9/h1-7H,(H,14,15)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM33624
PNG
(MLS000105423 | SMR000102304 | cid_2838744)
Show SMILES Cc1ccc2n3CCCNC4CCCc(c34)c2c1
Show InChI InChI=1S/C16H20N2/c1-11-6-7-15-13(10-11)12-4-2-5-14-16(12)18(15)9-3-8-17-14/h6-7,10,14,17H,2-5,8-9H2,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76328
PNG
(MLS000681264 | N-(2-methoxy-5-methyl-phenyl)-4-[(4...)
Show SMILES COc1ccc(C)cc1NC(=O)c1ccc(CN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C26H29N3O2/c1-20-8-13-25(31-2)24(18-20)27-26(30)22-11-9-21(10-12-22)19-28-14-16-29(17-15-28)23-6-4-3-5-7-23/h3-13,18H,14-17,19H2,1-2H3,(H,27,30)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM71174
PNG
(4-(1-benzimidazolyl)-1-methyl-3-nitro-2-quinolinon...)
Show SMILES Cn1c2ccccc2c(c([N+]([O-])=O)c1=O)-n1cnc2ccccc12 |(7.08,4.83,;7.08,3.29,;8.41,2.52,;9.79,3.35,;11.19,2.56,;11.19,.95,;9.79,.16,;8.41,.98,;7.08,.21,;5.75,.98,;4.41,.21,;3.08,.98,;4.41,-1.33,;5.75,2.52,;4.41,3.29,;7.08,-1.33,;5.84,-2.22,;6.31,-3.68,;7.84,-3.69,;8.87,-4.83,;10.38,-4.52,;10.86,-3.05,;9.83,-1.91,;8.32,-2.22,)|
Show InChI InChI=1S/C17H12N4O3/c1-19-13-8-4-2-6-11(13)15(16(17(19)22)21(23)24)20-10-18-12-7-3-5-9-14(12)20/h2-10H,1H3
PDB
MMDB

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UniChem

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PCBioAssay
n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
NACHT, LRR and PYD domains-containing protein 1


(Homo sapiens (Human))		BDBM76311
PNG
(1-(4-ethoxybenzyl)nipecotic acid ethyl ester | 1-[...)
Show SMILES CCOC(=O)C1CCCN(Cc2ccc(OCC)cc2)C1
Show InChI InChI=1S/C17H25NO3/c1-3-20-16-9-7-14(8-10-16)12-18-11-5-6-15(13-18)17(19)21-4-2/h7-10,15H,3-6,11-13H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22Z140X
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%