Compile Data Set for Download or QSAR

Found 569 hits of ec50 data for polymerid = 4755   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339301 (2-Amino-6-((R)-4-carboxy-4-(didodecylamino)butanam...) Show SMILES CCCCCCCCCCCCN(CCCCCCCCCCCC)[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C36H69N3O7/c1-3-5-7-9-11-13-15-17-19-21-28-39(29-22-20-18-16-14-12-10-8-6-4-2)32(36(45)46)26-27-33(40)38-31(35(43)44)25-23-24-30(37)34(41)42/h30-32H,3-29,37H2,1-2H3,(H,38,40)(H,41,42)(H,43,44)(H,45,46)/t30?,31?,32-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.00150	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339298 (2-Amino-6-((R)-4-carboxy-4-(dodecylamino)butanamid...) Show SMILES CCCCCCCCCCCCN[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C24H45N3O7/c1-2-3-4-5-6-7-8-9-10-11-17-26-19(23(31)32)15-16-21(28)27-20(24(33)34)14-12-13-18(25)22(29)30/h18-20,26H,2-17,25H2,1H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)/t18?,19-,20?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.0230	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339295 (2-Amino-6-((R)-4-carboxy-4-dodecanamidobutanamido)...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C24H43N3O8/c1-2-3-4-5-6-7-8-9-10-14-20(28)27-19(24(34)35)15-16-21(29)26-18(23(32)33)13-11-12-17(25)22(30)31/h17-19H,2-16,25H2,1H3,(H,26,29)(H,27,28)(H,30,31)(H,32,33)(H,34,35)/t17?,18?,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.0270	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339304 (2-Amino-6-((R)-4-amino-5-oxo-5-(undecyloxy)pentana...) Show SMILES CCCCCCCCCCCOC(=O)[C@H](N)CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H43N3O7/c1-2-3-4-5-6-7-8-9-10-16-33-23(32)18(25)14-15-20(27)26-19(22(30)31)13-11-12-17(24)21(28)29/h17-19H,2-16,24-25H2,1H3,(H,26,27)(H,28,29)(H,30,31)/t17?,18-,19?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.0660	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339308 (2-Amino-6-((R)-4-dodecanamido-5-ethoxy-5-oxopentan...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(=O)OCC |r| Show InChI InChI=1S/C26H47N3O8/c1-3-5-6-7-8-9-10-11-12-16-22(30)29-21(26(36)37-4-2)17-18-23(31)28-20(25(34)35)15-13-14-19(27)24(32)33/h19-21H,3-18,27H2,1-2H3,(H,28,31)(H,29,30)(H,32,33)(H,34,35)/t19?,20?,21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.0690	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339300 (2-Amino-6-((R)-4-carboxy-4-(dihexadecylamino)butan...) Show SMILES CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C44H85N3O7/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36-47(37-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)40(44(53)54)34-35-41(48)46-39(43(51)52)33-31-32-38(45)42(49)50/h38-40H,3-37,45H2,1-2H3,(H,46,48)(H,49,50)(H,51,52)(H,53,54)/t38?,39?,40-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.120	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339306 (2-Amino-6-((R)-4-dodecanamido-5-oxo-5-(undecyloxy)...) Show SMILES CCCCCCCCCCCOC(=O)[C@@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)NC(=O)CCCCCCCCCCC |r| Show InChI InChI=1S/C35H65N3O8/c1-3-5-7-9-11-13-15-17-19-24-31(39)38-30(35(45)46-27-20-18-16-14-12-10-8-6-4-2)25-26-32(40)37-29(34(43)44)23-21-22-28(36)33(41)42/h28-30H,3-27,36H2,1-2H3,(H,37,40)(H,38,39)(H,41,42)(H,43,44)/t28?,29?,30-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.134	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339310 ((2R)-5-((6-Amino-1,7-diethoxy-1,7-dioxoheptan-2-yl...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NC(CCCC(N)C(=O)OCC)C(=O)OCC)C(O)=O |r| Show InChI InChI=1S/C28H51N3O8/c1-4-7-8-9-10-11-12-13-14-18-24(32)30-22(26(34)35)19-20-25(33)31-23(28(37)39-6-3)17-15-16-21(29)27(36)38-5-2/h21-23H,4-20,29H2,1-3H3,(H,30,32)(H,31,33)(H,34,35)/t21?,22-,23?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.145	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339309 (CHEMBL1689707 | Diethyl 2-Amino-6-((R)-4-amino-5-o...) Show SMILES CCCCCCCCCCCSC(=O)[C@H](N)CCC(=O)NC(CCCC(N)C(=O)OCC)C(=O)OCC |r| Show InChI InChI=1S/C27H51N3O6S/c1-4-7-8-9-10-11-12-13-14-20-37-27(34)22(29)18-19-24(31)30-23(26(33)36-6-3)17-15-16-21(28)25(32)35-5-2/h21-23H,4-20,28-29H2,1-3H3,(H,30,31)/t21?,22-,23?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.181	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339299 (2-Amino-6-((R)-4-carboxy-4-(dioctylamino)butanamid...) Show SMILES CCCCCCCCN(CCCCCCCC)[C@H](CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C28H53N3O7/c1-3-5-7-9-11-13-20-31(21-14-12-10-8-6-4-2)24(28(37)38)18-19-25(32)30-23(27(35)36)17-15-16-22(29)26(33)34/h22-24H,3-21,29H2,1-2H3,(H,30,32)(H,33,34)(H,35,36)(H,37,38)/t22?,23?,24-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.200	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339307 ((15R)-10,6-Dibenzyl 15-Ethyl-2,2-dimethyl-4,12,17-...) Show SMILES [#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#8]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]-[#6](-[#7])-[#6](-[#8])=O)-[#6](-[#8])=O)\[#7]=[#6](\[#7])-[#7] |r| Show InChI InChI=1S/C24H45N5O7/c1-2-3-4-5-6-7-8-9-10-16-36-23(35)19(29-24(26)27)14-15-20(30)28-18(22(33)34)13-11-12-17(25)21(31)32/h17-19H,2-16,25H2,1H3,(H,28,30)(H,31,32)(H,33,34)(H4,26,27,29)/t17?,18?,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.238	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339317 ((R)-2-Amino-6-((R)-4-carboxy-4-dodecanamidobutanam...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NCCCC[C@@H](N)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H43N3O6/c1-2-3-4-5-6-7-8-9-10-14-21(28)26-19(23(31)32)15-16-20(27)25-17-12-11-13-18(24)22(29)30/h18-19H,2-17,24H2,1H3,(H,25,27)(H,26,28)(H,29,30)(H,31,32)/t18-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.370	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339312 (2-Amino-6-(5-oxo-5-(undecyloxy)pentanamido)heptane...) Show SMILES CCCCCCCCCCCOC(=O)CCCC(=O)NC(CCCC(N)C(O)=O)C(O)=O Show InChI InChI=1S/C23H42N2O7/c1-2-3-4-5-6-7-8-9-10-17-32-21(27)16-12-15-20(26)25-19(23(30)31)14-11-13-18(24)22(28)29/h18-19H,2-17,24H2,1H3,(H,25,26)(H,28,29)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.390	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339311 (2-Amino-6-(4-dodecanamidobutanamido)heptanedioic A...) Show SMILES CCCCCCCCCCCC(=O)NCCCC(=O)NC(CCCC(N)C(O)=O)C(O)=O Show InChI InChI=1S/C23H43N3O6/c1-2-3-4-5-6-7-8-9-10-15-20(27)25-17-12-16-21(28)26-19(23(31)32)14-11-13-18(24)22(29)30/h18-19H,2-17,24H2,1H3,(H,25,27)(H,26,28)(H,29,30)(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.504	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339296 (2-((R)-4-Amino-4-carboxybutanamido)-6-dodecanamido...) Show SMILES CCCCCCCCCCCC(=O)NC(CCCC(NC(=O)CC[C@@H](N)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C24H43N3O8/c1-2-3-4-5-6-7-8-9-10-14-20(28)26-18(23(32)33)12-11-13-19(24(34)35)27-21(29)16-15-17(25)22(30)31/h17-19H,2-16,25H2,1H3,(H,26,28)(H,27,29)(H,30,31)(H,32,33)(H,34,35)/t17-,18?,19?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.550	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339318 ((S)-6-Amino-2-((R)-4-carboxy-4-dodecanamidobutanam...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)N[C@@H](CCCCN)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H43N3O6/c1-2-3-4-5-6-7-8-9-10-14-20(27)26-19(23(31)32)15-16-21(28)25-18(22(29)30)13-11-12-17-24/h18-19H,2-17,24H2,1H3,(H,25,28)(H,26,27)(H,29,30)(H,31,32)/t18-,19+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.570	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339297 (2-((R)-4-Carboxy-4-dodecanamidobutanamido)-6-dodec...) Show SMILES CCCCCCCCCCCC(=O)NC(CCCC(NC(=O)CC[C@@H](NC(=O)CCCCCCCCCCC)C(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C36H65N3O9/c1-3-5-7-9-11-13-15-17-19-24-31(40)37-28(34(43)44)22-21-23-29(35(45)46)38-33(42)27-26-30(36(47)48)39-32(41)25-20-18-16-14-12-10-8-6-4-2/h28-30H,3-27H2,1-2H3,(H,37,40)(H,38,42)(H,39,41)(H,43,44)(H,45,46)(H,47,48)/t28?,29?,30-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.580	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339303 (2-((R)-4-Carboxy-4-dodecanamidobutanamido)-6-guani...) Show SMILES [#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6](=O)-[#7]-[#6](-[#6]-[#6]-[#6]-[#6](\[#7]=[#6](\[#7])-[#7])-[#6](-[#8])=O)-[#6](-[#8])=O)-[#6](-[#8])=O |r| Show InChI InChI=1S/C25H45N5O8/c1-2-3-4-5-6-7-8-9-10-14-20(31)29-19(24(37)38)15-16-21(32)28-17(22(33)34)12-11-13-18(23(35)36)30-25(26)27/h17-19H,2-16H2,1H3,(H,28,32)(H,29,31)(H,33,34)(H,35,36)(H,37,38)(H4,26,27,30)/t17?,18?,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.622	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339305 (2-Amino-6-((R)-4-amino-5-oxo-5-(undecylamino)penta...) Show SMILES CCCCCCCCCCCNC(=O)[C@H](N)CCC(=O)NC(CCCC(N)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H44N4O6/c1-2-3-4-5-6-7-8-9-10-16-26-21(29)17(24)14-15-20(28)27-19(23(32)33)13-11-12-18(25)22(30)31/h17-19H,2-16,24-25H2,1H3,(H,26,29)(H,27,28)(H,30,31)(H,32,33)/t17-,18?,19?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.826	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339319 ((S)-2-Amino-6-((R)-4-carboxy-4-dodecanamidobutanam...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NCCCC[C@H](N)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H43N3O6/c1-2-3-4-5-6-7-8-9-10-14-21(28)26-19(23(31)32)15-16-20(27)25-17-12-11-13-18(24)22(29)30/h18-19H,2-17,24H2,1H3,(H,25,27)(H,26,28)(H,29,30)(H,31,32)/t18-,19+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.960	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339302 ((2R)-5-((4-(2-Amino-4-oxo-4,5-dihydro-1H-imidazol-...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NC(CCCc1[nH]c(N)nc1O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C25H43N5O7/c1-2-3-4-5-6-7-8-9-10-14-20(31)28-19(24(36)37)15-16-21(32)27-18(23(34)35)13-11-12-17-22(33)30-25(26)29-17/h18-19,33H,2-16H2,1H3,(H,27,32)(H,28,31)(H,34,35)(H,36,37)(H3,26,29,30)/t18?,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.31	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339315 ((2R)-2-Dodecanamido-5-oxo-5-((2-oxoazepan-3-yl)ami...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NC1CCCCNC1=O)C(O)=O |r| Show InChI InChI=1S/C23H41N3O5/c1-2-3-4-5-6-7-8-9-10-14-20(27)26-19(23(30)31)15-16-21(28)25-18-13-11-12-17-24-22(18)29/h18-19H,2-17H2,1H3,(H,24,29)(H,25,28)(H,26,27)(H,30,31)/t18?,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.73	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339313 (2-((R)-4-Carboxy-4-dodecanamidobutanamido)heptaned...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NC(CCCCC(O)=O)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C24H42N2O8/c1-2-3-4-5-6-7-8-9-10-14-20(27)26-19(24(33)34)16-17-21(28)25-18(23(31)32)13-11-12-15-22(29)30/h18-19H,2-17H2,1H3,(H,25,28)(H,26,27)(H,29,30)(H,31,32)(H,33,34)/t18?,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>100	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339316 ((R)-6-Amino-2-((R)-4-carboxy-4-dodecanamidobutanam...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)N[C@H](CCCCN)C(O)=O)C(O)=O |r| Show InChI InChI=1S/C23H43N3O6/c1-2-3-4-5-6-7-8-9-10-14-20(27)26-19(23(31)32)15-16-21(28)25-18(22(29)30)13-11-12-17-24/h18-19H,2-17,24H2,1H3,(H,25,28)(H,26,27)(H,29,30)(H,31,32)/t18-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>100	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM50339314 ((R)-5-((5-Aminopentyl)amino)-2-dodecanamido-5-oxop...) Show SMILES CCCCCCCCCCCC(=O)N[C@H](CCC(=O)NCCCCCN)C(O)=O |r| Show InChI InChI=1S/C22H43N3O4/c1-2-3-4-5-6-7-8-9-11-14-21(27)25-19(22(28)29)15-16-20(26)24-18-13-10-12-17-23/h19H,2-18,23H2,1H3,(H,24,26)(H,25,27)(H,28,29)/t19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>100	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis				J Med Chem 54: 1490-510 (2011) Article DOI: 10.1021/jm101535e BindingDB Entry DOI: 10.7270/Q2PV6KPQ
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54484 (MLS001122505 | N-[1-(2,3-dimethylphenyl)-4,5,6,7-t...) Show SMILES Cc1cc(C(=O)NC2CCCc3c2cnn3-c2cccc(C)c2C)n(C)n1 Show InChI InChI=1S/C21H25N5O/c1-13-7-5-9-18(15(13)3)26-19-10-6-8-17(16(19)12-22-26)23-21(27)20-11-14(2)24-25(20)4/h5,7,9,11-12,17H,6,8,10H2,1-4H3,(H,23,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	170	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54367 (2-[(4E)-1-(1,3-benzothiazol-2-yl)-4-[1-(4-methoxya...) Show SMILES COC(=O)Cc1[nH]n(-c2nc3ccccc3s2)c(=O)c1C(C)=Nc1ccc(OC)cc1 |w:22.25| Show InChI InChI=1S/C22H20N4O4S/c1-13(23-14-8-10-15(29-2)11-9-14)20-17(12-19(27)30-3)25-26(21(20)28)22-24-16-6-4-5-7-18(16)31-22/h4-11,25H,12H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	310	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54393 (2,2-dimethyl-N-[N'-(5-methyl-1,3-benzoxazol-2-yl)a...) Show SMILES Cc1ccc2oc(N=C(N)NC(=O)C(C)(C)C)nc2c1 |w:7.6| Show InChI InChI=1S/C14H18N4O2/c1-8-5-6-10-9(7-8)16-13(20-10)18-12(15)17-11(19)14(2,3)4/h5-7H,1-4H3,(H3,15,16,17,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	310	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM48658 (3-amyl-7-(4-piperonylpiperazine-1-carbonyl)-1H-qui...) Show SMILES CCCCCn1c(=O)[nH]c2cc(ccc2c1=O)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1 Show InChI InChI=1S/C26H30N4O5/c1-2-3-4-9-30-25(32)20-7-6-19(15-21(20)27-26(30)33)24(31)29-12-10-28(11-13-29)16-18-5-8-22-23(14-18)35-17-34-22/h5-8,14-15H,2-4,9-13,16-17H2,1H3,(H,27,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	360	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM59542 ((1-tosylbenzimidazol-2-yl)amine | 1-(4-methylpheny...) Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12 Show InChI InChI=1S/C14H13N3O2S/c1-10-6-8-11(9-7-10)20(18,19)17-13-5-3-2-4-12(13)16-14(17)15/h2-9H,1H3,(H2,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	460	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54526 (MLS001159274 | N-[3-(diethylsulfamoyl)phenyl]-2-(3...) Show SMILES CCN(CC)S(=O)(=O)c1cccc(NC(=O)CNc2cccc(c2)S(=O)(=O)N2CCCC2)c1 Show InChI InChI=1S/C22H30N4O5S2/c1-3-25(4-2)32(28,29)21-12-8-10-19(16-21)24-22(27)17-23-18-9-7-11-20(15-18)33(30,31)26-13-5-6-14-26/h7-12,15-16,23H,3-6,13-14,17H2,1-2H3,(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	560	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM37016 (MLS000056239 | N-[2-[2-[2,5-dimethyl-1-(2-thenyl)p...) Show SMILES CC(=O)Nc1ccccc1OCC(=O)c1cc(C)n(Cc2cccs2)c1C Show InChI InChI=1S/C21H22N2O3S/c1-14-11-18(15(2)23(14)12-17-7-6-10-27-17)20(25)13-26-21-9-5-4-8-19(21)22-16(3)24/h4-11H,12-13H2,1-3H3,(H,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	566	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54524 (MLS001101361 | N-[1-(2-fluorophenyl)-4,5,6,7-tetra...) Show SMILES Cn1nccc1C(=O)NC1CCCc2c1cnn2-c1ccccc1F Show InChI InChI=1S/C18H18FN5O/c1-23-17(9-10-20-23)18(25)22-14-6-4-8-15-12(14)11-21-24(15)16-7-3-2-5-13(16)19/h2-3,5,7,9-11,14H,4,6,8H2,1H3,(H,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	620	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54531 (2-(2-keto-4-phenyl-chromen-7-yl)oxy-N-(3-pyridyl)a...) Show SMILES O=C(COc1ccc2c(cc(=O)oc2c1)-c1ccccc1)Nc1cccnc1 Show InChI InChI=1S/C22H16N2O4/c25-21(24-16-7-4-10-23-13-16)14-27-17-8-9-18-19(15-5-2-1-3-6-15)12-22(26)28-20(18)11-17/h1-13H,14H2,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	750	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM59544 (4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-eth...) Show SMILES CCOc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1 Show InChI InChI=1S/C25H26N2O2/c1-2-29-24-13-11-23(12-14-24)26-25(28)21-9-7-19(8-10-21)17-27-16-15-20-5-3-4-6-22(20)18-27/h3-14H,2,15-18H2,1H3,(H,26,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	790	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54384 (MLS000757219 | N-(4-bromanylnaphthalen-1-yl)-1-oxi...) Show SMILES Oc1c(ccc2ccccc12)C(=O)Nc1ccc(Br)c2ccccc12 Show InChI InChI=1S/C21H14BrNO2/c22-18-11-12-19(16-8-4-3-7-15(16)18)23-21(25)17-10-9-13-5-1-2-6-14(13)20(17)24/h1-12,24H,(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	790	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54409 (4-[4-(3,4-Dihydro-1H-isoquinolin-2-ylmethyl)-benzo...) Show SMILES CCOC(=O)c1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1 Show InChI InChI=1S/C26H26N2O3/c1-2-31-26(30)22-11-13-24(14-12-22)27-25(29)21-9-7-19(8-10-21)17-28-16-15-20-5-3-4-6-23(20)18-28/h3-14H,2,15-18H2,1H3,(H,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	850	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54188 (1-(3-methylphenyl)-3-[(Z)-(2-oxidanylidene-1-prop-...) Show SMILES Cc1cccc(NC(=S)NN=C2C(=O)N(CC=C)c3ccccc23)c1 |w:10.9| Show InChI InChI=1S/C19H18N4OS/c1-3-11-23-16-10-5-4-9-15(16)17(18(23)24)21-22-19(25)20-14-8-6-7-13(2)12-14/h3-10,12H,1,11H2,2H3,(H2,20,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54477 (MLS001097022 | N-(3,4-dimethoxyphenyl)-4-(2-methyl...) Show SMILES COc1ccc(NS(=O)(=O)c2ccc(cc2)-c2coc(C)n2)cc1OC Show InChI InChI=1S/C18H18N2O5S/c1-12-19-16(11-25-12)13-4-7-15(8-5-13)26(21,22)20-14-6-9-17(23-2)18(10-14)24-3/h4-11,20H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54451 (3-[[3-(dimethylsulfamoyl)phenyl]methylsulfanylmeth...) Show SMILES CN(C)S(=O)(=O)c1cccc(CSCc2cccc(c2)S(=O)(=O)N(C)C)c1 Show InChI InChI=1S/C18H24N2O4S3/c1-19(2)26(21,22)17-9-5-7-15(11-17)13-25-14-16-8-6-10-18(12-16)27(23,24)20(3)4/h5-12H,13-14H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54453 (1-phenylethyl(thieno[2,3-d]pyrimidin-4-yl)amine | ...) Show SMILES CC(Nc1ncnc2sccc12)c1ccccc1 Show InChI InChI=1S/C14H13N3S/c1-10(11-5-3-2-4-6-11)17-13-12-7-8-18-14(12)16-9-15-13/h2-10H,1H3,(H,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54259 ((2Z,3Z)-2-[4-(4-ethoxyphenyl)-3H-1,3-thiazol-2-yli...) Show SMILES CCOc1ccc(cc1)-c1csc([nH+]1)C(=C\[c-]1ccc(=O)c(c1)[N+]([O-])=O)\C#N Show InChI InChI=1S/C20H14N3O4S/c1-2-27-16-6-4-14(5-7-16)17-12-28-20(22-17)15(11-21)9-13-3-8-19(24)18(10-13)23(25)26/h3-10,12H,2H2,1H3/q-1/p+1/b15-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.52E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54488 (MLS001121495 | N-[5-(1-azepanylsulfonyl)-1,3,4-thi...) Show SMILES Brc1ccc(cc1)C(=O)Nc1nnc(s1)S(=O)(=O)N1CCCCCC1 Show InChI InChI=1S/C15H17BrN4O3S2/c16-12-7-5-11(6-8-12)13(21)17-14-18-19-15(24-14)25(22,23)20-9-3-1-2-4-10-20/h5-8H,1-4,9-10H2,(H,17,18,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.56E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM53772 (2-[(2-{[(2-fluorophenyl)sulfonyl]amino}phenyl)sulf...) Show SMILES Fc1ccccc1S(=O)(=O)Nc1ccccc1SCC(=O)Nc1nnc(s1)C(F)(F)F Show InChI InChI=1S/C17H12F4N4O3S3/c18-10-5-1-4-8-13(10)31(27,28)25-11-6-2-3-7-12(11)29-9-14(26)22-16-24-23-15(30-16)17(19,20)21/h1-8,25H,9H2,(H,22,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54211 (2-(4-chlorophenyl)sulfanyl-1-methyl-indole-3-carba...) Show SMILES Cn1c(Sc2ccc(Cl)cc2)c(C=O)c2ccccc12 Show InChI InChI=1S/C16H12ClNOS/c1-18-15-5-3-2-4-13(15)14(10-19)16(18)20-12-8-6-11(17)7-9-12/h2-10H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.63E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54292 (MLS000856485 | N-(2-oxolanylmethyl)-4-[4-(2-oxolan...) Show SMILES O=S(=O)(NCC1CCCO1)c1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCC1CCCO1 Show InChI InChI=1S/C22H28N2O6S2/c25-31(26,23-15-19-3-1-13-29-19)21-9-5-17(6-10-21)18-7-11-22(12-8-18)32(27,28)24-16-20-4-2-14-30-20/h5-12,19-20,23-24H,1-4,13-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.65E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54470 (1-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]sul...) Show SMILES CCC(=O)N1C(C)Cc2cc(ccc12)S(=O)(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C22H26N4O5S/c1-3-22(27)25-16(2)14-17-15-20(8-9-21(17)25)32(30,31)24-12-10-23(11-13-24)18-4-6-19(7-5-18)26(28)29/h4-9,15-16H,3,10-14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.67E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54456 (MLS001172367 | N-[(2-methoxyphenyl)methyl]-4-thien...) Show SMILES COc1ccccc1CNc1ncnc2sccc12 Show InChI InChI=1S/C14H13N3OS/c1-18-12-5-3-2-4-10(12)8-15-13-11-6-7-19-14(11)17-9-16-13/h2-7,9H,8H2,1H3,(H,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.69E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54483 (3-fluoranyl-N-[5-[(4-methoxyphenyl)methyl-methyl-s...) Show SMILES COc1ccc(CN(C)S(=O)(=O)c2nnc(NC(=O)c3cccc(F)c3)s2)cc1 Show InChI InChI=1S/C18H17FN4O4S2/c1-23(11-12-6-8-15(27-2)9-7-12)29(25,26)18-22-21-17(28-18)20-16(24)13-4-3-5-14(19)10-13/h3-10H,11H2,1-2H3,(H,20,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair
Nucleotide-binding oligomerization domain-containing protein 1 (Homo sapiens (Human))	BDBM54313 (1-azepanyl-[5-(6-quinolinyloxymethyl)-3-isoxazolyl...) Show SMILES O=C(N1CCCCCC1)c1cc(COc2ccc3ncccc3c2)on1 Show InChI InChI=1S/C20H21N3O3/c24-20(23-10-3-1-2-4-11-23)19-13-17(26-22-19)14-25-16-7-8-18-15(12-16)6-5-9-21-18/h5-9,12-13H,1-4,10-11,14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.85E+3	n/a	n/a	n/a	n/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/Q2CN72C0
					More data for this Ligand-Target Pair

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