Found 47 hits with Last Name = 'fraser' and Initial = 'n' 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 |
|---|
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011370
(CHEMBL3261022)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H33NO5/c1-14(2)20-21(15-12-18(31-5)26(33-7)19(13-15)32-6)22-23-25(34-28(3,4)24(20)22)16-10-8-9-11-17(16)29-27(23)30/h8-14,20-22,24H,1-7H3,(H,29,30)/t20-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 790 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011469
(CHEMBL3261021)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(F)c1 |r| Show InChI InChI=1S/C24H24FNO3/c1-12-18(13-9-10-17(28-4)15(25)11-13)19-20-22(29-24(2,3)21(12)19)14-7-5-6-8-16(14)26-23(20)27/h5-12,18-19,21H,1-4H3,(H,26,27)/t12-,18+,19+,21+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011372
(CHEMBL3261024)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(CCl)c1 |r| Show InChI InChI=1S/C27H30ClNO3/c1-14(2)20-21(15-10-11-19(31-5)16(12-15)13-28)22-23-25(32-27(3,4)24(20)22)17-8-6-7-9-18(17)29-26(23)30/h6-12,14,20-22,24H,13H2,1-5H3,(H,29,30)/t20-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011373
(CHEMBL3261025)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC(O)=O)c1 |r| Show InChI InChI=1S/C27H29NO6/c1-13(2)19-20(14-10-11-17(32-5)18(12-14)33-26(30)31)21-22-24(34-27(3,4)23(19)21)15-8-6-7-9-16(15)28-25(22)29/h6-13,19-21,23H,1-5H3,(H,28,29)(H,30,31)/t19-,20-,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011374
(CHEMBL3261026)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C27H31NO4/c1-14(2)20-21(15-11-12-18(30-5)19(13-15)31-6)22-23-25(32-27(3,4)24(20)22)16-9-7-8-10-17(16)28-26(23)29/h7-14,20-22,24H,1-6H3,(H,28,29)/t20-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011375
(CHEMBL3261027)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC(=O)CCC(O)=O)c1 |r| Show InChI InChI=1S/C30H33NO7/c1-15(2)23-24(16-10-11-19(36-5)20(14-16)37-22(34)13-12-21(32)33)25-26-28(38-30(3,4)27(23)25)17-8-6-7-9-18(17)31-29(26)35/h6-11,14-15,23-25,27H,12-13H2,1-5H3,(H,31,35)(H,32,33)/t23-,24-,25+,27+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 6.30E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011376
(CHEMBL3261028)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OCC)c(OC)c1 |r| Show InChI InChI=1S/C28H33NO4/c1-7-32-19-13-12-16(14-20(19)31-6)22-21(15(2)3)25-23(22)24-26(33-28(25,4)5)17-10-8-9-11-18(17)29-27(24)30/h8-15,21-23,25H,7H2,1-6H3,(H,29,30)/t21-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011377
(CHEMBL3261029)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OCCO)c1 |r| Show InChI InChI=1S/C28H33NO5/c1-15(2)21-22(16-10-11-19(32-5)20(14-16)33-13-12-30)23-24-26(34-28(3,4)25(21)23)17-8-6-7-9-18(17)29-27(24)31/h6-11,14-15,21-23,25,30H,12-13H2,1-5H3,(H,29,31)/t21-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 500 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011378
(CHEMBL3261030)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OCCCO)c1 |r| Show InChI InChI=1S/C29H33NO5/c1-29(2)26-23(16-9-10-16)22(17-11-12-20(33-3)21(15-17)34-14-6-13-31)24(26)25-27(35-29)18-7-4-5-8-19(18)30-28(25)32/h4-5,7-8,11-12,15-16,22-24,26,31H,6,9-10,13-14H2,1-3H3,(H,30,32)/t22-,23-,24+,26+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 790 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011379
(CHEMBL3261031)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C27H29NO4/c1-27(2)24-21(14-9-10-14)20(15-11-12-18(30-3)19(13-15)31-4)22(24)23-25(32-27)16-7-5-6-8-17(16)28-26(23)29/h5-8,11-14,20-22,24H,9-10H2,1-4H3,(H,28,29)/t20-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 630 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011380
(CHEMBL3261032)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H31NO5/c1-28(2)24-21(14-10-11-14)20(15-12-18(31-3)26(33-5)19(13-15)32-4)22(24)23-25(34-28)16-8-6-7-9-17(16)29-27(23)30/h6-9,12-14,20-22,24H,10-11H2,1-5H3,(H,29,30)/t20-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 630 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011381
(CHEMBL3261033)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OCCCN2CCOCC2)c1 |r| Show InChI InChI=1S/C33H40N2O5/c1-33(2)30-27(20-9-10-20)26(28(30)29-31(40-33)22-7-4-5-8-23(22)34-32(29)36)21-11-12-24(37-3)25(19-21)39-16-6-13-35-14-17-38-18-15-35/h4-5,7-8,11-12,19-20,26-28,30H,6,9-10,13-18H2,1-3H3,(H,34,36)/t26-,27-,28+,30+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011382
(CHEMBL3261034)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CCCC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C29H33NO4/c1-29(2)26-23(16-9-5-6-10-16)22(17-13-14-20(32-3)21(15-17)33-4)24(26)25-27(34-29)18-11-7-8-12-19(18)30-28(25)31/h7-8,11-16,22-24,26H,5-6,9-10H2,1-4H3,(H,30,31)/t22-,23-,24+,26+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 390 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011383
(CHEMBL3261035)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CCCC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C30H35NO5/c1-30(2)26-23(16-10-6-7-11-16)22(17-14-20(33-3)28(35-5)21(15-17)34-4)24(26)25-27(36-30)18-12-8-9-13-19(18)31-29(25)32/h8-9,12-16,22-24,26H,6-7,10-11H2,1-5H3,(H,31,32)/t22-,23-,24+,26+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 630 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011384
(CHEMBL3261036)Show SMILES [H][C@@]12[C@@H]([C@@H](CCCC)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C29H35NO5/c1-7-8-11-18-22(16-14-20(32-4)27(34-6)21(15-16)33-5)23-24-26(35-29(2,3)25(18)23)17-12-9-10-13-19(17)30-28(24)31/h9-10,12-15,18,22-23,25H,7-8,11H2,1-6H3,(H,30,31)/t18-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011385
(CHEMBL3261037)Show SMILES [H][C@@]12[C@@H]([C@@H](CCCC)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H33NO4/c1-6-7-10-18-22(16-13-14-20(31-4)21(15-16)32-5)23-24-26(33-28(2,3)25(18)23)17-11-8-9-12-19(17)29-27(24)30/h8-9,11-15,18,22-23,25H,6-7,10H2,1-5H3,(H,29,30)/t18-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011386
(CHEMBL3261038)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)=O)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C26H27NO5/c1-13(28)19-20(14-10-11-17(30-4)18(12-14)31-5)21-22-24(32-26(2,3)23(19)21)15-8-6-7-9-16(15)27-25(22)29/h6-12,19-21,23H,1-5H3,(H,27,29)/t19-,20-,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011387
(CHEMBL3261039)Show SMILES [H][C@@]12[C@@H]([C@@H](C(=O)C3CC3)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H29NO5/c1-28(2)24-21(23-26(34-28)16-7-5-6-8-17(16)29-27(23)31)20(22(24)25(30)14-9-10-14)15-11-12-18(32-3)19(13-15)33-4/h5-8,11-14,20-22,24H,9-10H2,1-4H3,(H,29,31)/t20-,21-,22+,24+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.90E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011388
(CHEMBL3261041)Show SMILES [H][C@@]12[C@@H]([C@@H](COC(C)=O)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H31NO7/c1-14(30)35-13-17-21(15-11-19(32-4)26(34-6)20(12-15)33-5)22-23-25(36-28(2,3)24(17)22)16-9-7-8-10-18(16)29-27(23)31/h7-12,17,21-22,24H,13H2,1-6H3,(H,29,31)/t17-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011389
(CHEMBL3261246)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C26H29NO4/c1-14-20(15-11-12-18(29-5)19(13-15)30-6)21-22-24(31-26(2,3)23(14)21)16-9-7-8-10-17(16)27(4)25(22)28/h7-14,20-21,23H,1-6H3/t14-,20+,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011390
(CHEMBL3261247)Show SMILES [H][C@@]12[C@@H]([C@@H](CC)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C27H31NO4/c1-7-16-21(15-12-13-19(30-5)20(14-15)31-6)22-23-25(32-27(2,3)24(16)22)17-10-8-9-11-18(17)28(4)26(23)29/h8-14,16,21-22,24H,7H2,1-6H3/t16-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011391
(CHEMBL3261248)Show SMILES [H][C@@]12[C@@H]([C@@H](CC)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccccc12)c1ccc(OC)c(F)c1 |r| Show InChI InChI=1S/C26H28FNO3/c1-6-15-20(14-11-12-19(30-5)17(27)13-14)21-22-24(31-26(2,3)23(15)21)16-9-7-8-10-18(16)28(4)25(22)29/h7-13,15,20-21,23H,6H2,1-5H3/t15-,20-,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011392
(CHEMBL3261249)Show SMILES [H][C@@]12[C@@H]([C@@H](CC)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccc(C)cc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C29H35NO5/c1-9-17-22(16-13-20(32-6)27(34-8)21(14-16)33-7)23-24-26(35-29(3,4)25(17)23)18-12-15(2)10-11-19(18)30(5)28(24)31/h10-14,17,22-23,25H,9H2,1-8H3/t17-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011393
(CHEMBL3261250)Show SMILES [H][C@@]12[C@@H]([C@@H](CC)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccc(C)cc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H33NO4/c1-8-17-22(16-10-12-20(31-6)21(14-16)32-7)23-24-26(33-28(3,4)25(17)23)18-13-15(2)9-11-19(18)29(5)27(24)30/h9-14,17,22-23,25H,8H2,1-7H3/t17-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011399
(CHEMBL3261251)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccc(C)cc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C30H37NO5/c1-15(2)22-23(17-13-20(33-7)28(35-9)21(14-17)34-8)24-25-27(36-30(4,5)26(22)24)18-12-16(3)10-11-19(18)31(6)29(25)32/h10-15,22-24,26H,1-9H3/t22-,23-,24+,26+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.90E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011400
(CHEMBL3261252)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccccc12)c1ccc(OC)c(Cl)c1 |r| Show InChI InChI=1S/C27H30ClNO3/c1-14(2)20-21(15-11-12-19(31-6)17(28)13-15)22-23-25(32-27(3,4)24(20)22)16-9-7-8-10-18(16)29(5)26(23)30/h7-14,20-22,24H,1-6H3/t20-,21-,22+,24+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011401
(CHEMBL3261253)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccccc12)c1ccc(OC)c(OC(C)=O)c1 |r| Show InChI InChI=1S/C29H33NO5/c1-15(2)22-23(17-12-13-20(33-7)21(14-17)34-16(3)31)24-25-27(35-29(4,5)26(22)24)18-10-8-9-11-19(18)30(6)28(25)32/h8-15,22-24,26H,1-7H3/t22-,23-,24+,26+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011402
(CHEMBL3261254)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CC3)[C@]1([H])C(C)(C)Oc1c2c(=O)n(C)c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C29H33NO5/c1-29(2)25-22(15-11-12-15)21(16-13-19(32-4)27(34-6)20(14-16)33-5)23(25)24-26(35-29)17-9-7-8-10-18(17)30(3)28(24)31/h7-10,13-15,21-23,25H,11-12H2,1-6H3/t21-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 790 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011403
(CHEMBL3261255)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CC3)[C@]1([H])C(C)(C)Cc1c2c(=O)n(C)c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C29H33NO3/c1-29(2)15-19-18-8-6-7-9-20(18)30(3)28(31)25(19)26-23(24(27(26)29)16-10-11-16)17-12-13-21(32-4)22(14-17)33-5/h6-9,12-14,16,23-24,26-27H,10-11,15H2,1-5H3/t23-,24-,26+,27+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011404
(CHEMBL3261256)Show SMILES [H][C@@]12[C@@H]([C@@H](C3CCCC3)[C@]1([H])C(C)(C)Cc1c2c(=O)n(C)c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C32H39NO4/c1-32(2)17-21-20-13-9-10-14-22(20)33(3)31(34)27(21)28-25(26(29(28)32)18-11-7-8-12-18)19-15-23(35-4)30(37-6)24(16-19)36-5/h9-10,13-16,18,25-26,28-29H,7-8,11-12,17H2,1-6H3/t25-,26-,28+,29+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011405
(CHEMBL3261257)Show SMILES [H][C@]12[C@H](C)[C@@H](c3cc(OC)c(OC)c(OC)c3)[C@@]1([H])c1c(CC2C)c2ccccc2[nH]c1=O |r| Show InChI InChI=1S/C26H29NO4/c1-13-10-17-16-8-6-7-9-18(16)27-26(28)23(17)24-21(13)14(2)22(24)15-11-19(29-3)25(31-5)20(12-15)30-4/h6-9,11-14,21-22,24H,10H2,1-5H3,(H,27,28)/t13?,14-,21-,22-,24-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011406
(CHEMBL3261258)Show SMILES [H][C@]12[C@H](C)[C@@H](c3cc(OC)c(OC)c(OC)c3)[C@@]1([H])c1c(OC2C)c2ccccc2[nH]c1=O |r| Show InChI InChI=1S/C25H27NO5/c1-12-19-13(2)31-23-15-8-6-7-9-16(15)26-25(27)22(23)21(19)20(12)14-10-17(28-3)24(30-5)18(11-14)29-4/h6-13,19-21H,1-5H3,(H,26,27)/t12-,13?,19+,20-,21-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011407
(CHEMBL3261259)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccc(OC)cc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C28H33NO5/c1-14(2)21-22(15-8-11-19(32-6)20(12-15)33-7)23-24-26(34-28(3,4)25(21)23)17-13-16(31-5)9-10-18(17)29-27(24)30/h8-14,21-23,25H,1-7H3,(H,29,30)/t21-,22-,23+,25+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011408
(CHEMBL3261260)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccc(OC)cc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C27H31NO6/c1-13-20(14-10-18(31-5)25(33-7)19(11-14)32-6)21-22-24(34-27(2,3)23(13)21)16-12-15(30-4)8-9-17(16)28-26(22)29/h8-13,20-21,23H,1-7H3,(H,28,29)/t13-,20+,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011409
(CHEMBL3261261)Show SMILES [H][C@@]12O[C@@](CCC)(O[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)cc(OC)c1 |r| Show InChI InChI=1S/C26H29NO6/c1-6-11-26(15-12-16(29-4)14-17(13-15)30-5)32-22-20-21(31-25(2,3)23(22)33-26)18-9-7-8-10-19(18)27-24(20)28/h7-10,12-14,22-23H,6,11H2,1-5H3,(H,27,28)/t22-,23-,26-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011410
(CHEMBL3261262)Show SMILES [H][C@@]12O[C@@](CCC)(O[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C26H29NO6/c1-6-13-26(15-11-12-18(29-4)19(14-15)30-5)32-22-20-21(31-25(2,3)23(22)33-26)16-9-7-8-10-17(16)27-24(20)28/h7-12,14,22-23H,6,13H2,1-5H3,(H,27,28)/t22-,23-,26-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.58E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011411
(CHEMBL3261007)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C26H29NO5/c1-13-19(14-11-17(29-4)24(31-6)18(12-14)30-5)20-21-23(32-26(2,3)22(13)20)15-9-7-8-10-16(15)27-25(21)28/h7-13,19-20,22H,1-6H3,(H,27,28)/t13-,19+,20+,22+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011412
(CHEMBL3261010)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C25H27NO4/c1-13-19(14-10-11-17(28-4)18(12-14)29-5)20-21-23(30-25(2,3)22(13)20)15-8-6-7-9-16(15)26-24(21)27/h6-13,19-20,22H,1-5H3,(H,26,27)/t13-,19+,20+,22+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011413
(CHEMBL3261011)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)cc(OC)c1 |r| Show InChI InChI=1S/C25H27NO4/c1-13-19(14-10-15(28-4)12-16(11-14)29-5)20-21-23(30-25(2,3)22(13)20)17-8-6-7-9-18(17)26-24(21)27/h6-13,19-20,22H,1-5H3,(H,26,27)/t13-,19+,20+,22+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011414
(CHEMBL3261012)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(Br)c1 |r| Show InChI InChI=1S/C24H24BrNO3/c1-12-18(13-9-10-17(28-4)15(25)11-13)19-20-22(29-24(2,3)21(12)19)14-7-5-6-8-16(14)26-23(20)27/h5-12,18-19,21H,1-4H3,(H,26,27)/t12-,18+,19+,21+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011463
(CHEMBL3261013)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1Cl |r| Show InChI InChI=1S/C25H26ClNO4/c1-12-17(14-10-11-16(29-4)23(30-5)21(14)26)18-19-22(31-25(2,3)20(12)18)13-8-6-7-9-15(13)27-24(19)28/h6-12,17-18,20H,1-5H3,(H,27,28)/t12-,17+,18+,20+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011464
(CHEMBL3261015)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)cc1 |r| Show InChI InChI=1S/C24H25NO3/c1-13-18(14-9-11-15(27-4)12-10-14)19-20-22(28-24(2,3)21(13)19)16-7-5-6-8-17(16)25-23(20)26/h5-13,18-19,21H,1-4H3,(H,25,26)/t13-,18+,19+,21+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011465
(CHEMBL3261016)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1OC |r| Show InChI InChI=1S/C26H29NO5/c1-13-18(15-11-12-17(29-4)24(31-6)23(15)30-5)19-20-22(32-26(2,3)21(13)19)14-9-7-8-10-16(14)27-25(20)28/h7-13,18-19,21H,1-6H3,(H,27,28)/t13-,18+,19+,21+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011466
(CHEMBL3261018)Show SMILES [H][C@@]12[C@@H]([C@@H](C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(O)c(OC)c1 |r| Show InChI InChI=1S/C24H25NO4/c1-12-18(13-9-10-16(26)17(11-13)28-4)19-20-22(29-24(2,3)21(12)19)14-7-5-6-8-15(14)25-23(20)27/h5-12,18-19,21,26H,1-4H3,(H,25,27)/t12-,18+,19+,21+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011467
(CHEMBL3261019)Show SMILES [H][C@@]12[C@@H]([C@@H](CC)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(OC)c1 |r| Show InChI InChI=1S/C26H29NO4/c1-6-15-20(14-11-12-18(29-4)19(13-14)30-5)21-22-24(31-26(2,3)23(15)21)16-9-7-8-10-17(16)27-25(22)28/h7-13,15,20-21,23H,6H2,1-5H3,(H,27,28)/t15-,20-,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011468
(CHEMBL3261020)Show SMILES [H][C@@]12[C@@H]([C@@H](CC)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1cc(OC)c(OC)c(OC)c1 |r| Show InChI InChI=1S/C27H31NO5/c1-7-15-20(14-12-18(30-4)25(32-6)19(13-14)31-5)21-22-24(33-27(2,3)23(15)21)16-10-8-9-11-17(16)28-26(22)29/h8-13,15,20-21,23H,7H2,1-6H3,(H,28,29)/t15-,20-,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 790 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
Toll-like receptor 4
(Homo sapiens (Human)) | BDBM50011371
(CHEMBL3261023)Show SMILES [H][C@@]12[C@@H]([C@@H](C(C)C)[C@]1([H])C(C)(C)Oc1c2c(=O)[nH]c2ccccc12)c1ccc(OC)c(Cl)c1 |r| Show InChI InChI=1S/C26H28ClNO3/c1-13(2)19-20(14-10-11-18(30-5)16(27)12-14)21-22-24(31-26(3,4)23(19)21)15-8-6-7-9-17(15)28-25(22)29/h6-13,19-21,23H,1-5H3,(H,28,29)/t19-,20-,21+,23+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Agonist activity at human recombinant TLR4 expressed in HEK293 cells by SEAP reporter assay |
J Med Chem 57: 1252-75 (2014)
Article DOI: 10.1021/jm401321v
BindingDB Entry DOI: 10.7270/Q2N01823 |
More data for this
Ligand-Target Pair | |
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