Found 9 hits in this display 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 |
|---|
dTDP-4-dehydrorhamnose 3,5-epimerase
(Mycobacterium tuberculosis H37Rv) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 980 | n/a | n/a | n/a | n/a | n/a | n/a |
PCMD
Curated by PubChem BioAssay
| Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Michael McNeil, Colorado State Universi... |
PubChem Bioassay (2009)
BindingDB Entry DOI: 10.7270/Q2TD9VRT |
More data for this
Ligand-Target Pair | |
Receptor-interacting serine/threonine-protein kinase 2
(Homo sapiens (Human)) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 1.93E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| |
PubChem Bioassay (2012)
BindingDB Entry DOI: 10.7270/Q2T15278 |
More data for this
Ligand-Target Pair | |
X-box-binding protein 1
(Homo sapiens (Human)) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 7.73E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center
Curated by PubChem BioAssay
| Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer... |
PubChem Bioassay (2011)
BindingDB Entry DOI: 10.7270/Q2NK3CGB |
More data for this
Ligand-Target Pair | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center
Curated by PubChem BioAssay
| Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer... |
PubChem Bioassay (2010)
BindingDB Entry DOI: 10.7270/Q2PC30VZ |
More data for this
Ligand-Target Pair | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Emory University Molecular Libraries Screening Center
Curated by PubChem BioAssay
| Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer... |
PubChem Bioassay (2011)
BindingDB Entry DOI: 10.7270/Q28C9TQN |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 6
(Homo sapiens (Human)) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 2.14E+4 | n/a | n/a | 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, CA... |
PubChem Bioassay (2011)
BindingDB Entry DOI: 10.7270/Q20P0XHD |
More data for this
Ligand-Target Pair | |
Beta-lactamase
(Pseudomonas aeruginosa) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | PDB
MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 3.91E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| |
PubChem Bioassay (2012)
BindingDB Entry DOI: 10.7270/Q2XS5T0R |
More data for this
Ligand-Target Pair | |
Beta-galactosidase
(Escherichia coli) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | >6.66E+4 | n/a | n/a | 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 (2011)
BindingDB Entry DOI: 10.7270/Q2NG4P4X |
More data for this
Ligand-Target Pair | |
G-protein coupled receptor 55
(Homo sapiens (Human)) | BDBM51640
(1,3,3-trimethyl-2-[(E)-2-(2,3,4-trimethoxyphenyl)e...)Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)c(OC)c1OC)=[N+]2C |c:29| Show InChI InChI=1S/C24H28NO5/c1-24(2)17-14-16(23(26)30-7)8-11-18(17)25(3)20(24)13-10-15-9-12-19(27-4)22(29-6)21(15)28-5/h8-14H,1-7H3/q+1/b13-10+ | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | n/a | n/a | 1.51E+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/Q2GF0RZ3 |
More data for this
Ligand-Target Pair | |