Found 6 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 |
|---|
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM55675
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1 Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+ | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 2.17E+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/Q28C9TQN |
More data for this
Ligand-Target Pair | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM55675
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1 Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+ | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 2.17E+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 (2010)
BindingDB Entry DOI: 10.7270/Q2PC30VZ |
More data for this
Ligand-Target Pair | |
X-box-binding protein 1
(Homo sapiens (Human)) | BDBM55675
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1 Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+ | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 2.53E+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 | |
Neutrophil cytosol factor 1 [S99G]
(Homo sapiens (Human)) | BDBM55675
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1 Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 5.00E+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: Susan Smith, Emory Univers... |
PubChem Bioassay (2008)
BindingDB Entry DOI: 10.7270/Q2M90723 |
More data for this
Ligand-Target Pair | |
G-protein coupled receptor 55
(Homo sapiens (Human)) | BDBM55675
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1 Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+ | Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | n/a | n/a | 3.20E+4 | 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 | |
Heat shock factor protein 1
(Mus musculus) | BDBM55675
((E)-N-[2-(cyclohexylamino)-2-keto-ethyl]-N-(4-fluo...)Show SMILES COc1ccc(C(=O)\C=C\C(=O)N(CC(=O)NC2CCCCC2)Cc2ccc(F)cc2)c(O)c1 Show InChI InChI=1S/C26H29FN2O5/c1-34-21-11-12-22(24(31)15-21)23(30)13-14-26(33)29(16-18-7-9-19(27)10-8-18)17-25(32)28-20-5-3-2-4-6-20/h7-15,20,31H,2-6,16-17H2,1H3,(H,28,32)/b14-13+ | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | n/a | n/a | 5.29E+3 | n/a | n/a | n/a | n/a |
Broad Institute
Curated by PubChem BioAssay
| Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly... |
PubChem Bioassay (2010)
BindingDB Entry DOI: 10.7270/Q2MW2FKX |
More data for this
Ligand-Target Pair | |