Found 5 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 |
|---|
X-box-binding protein 1
(Homo sapiens (Human)) | BDBM47995
(2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-ket...)Show SMILES O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C18H15NO6S/c20-14(12-6-7-15-16(10-12)25-9-3-8-24-15)11-19-18(21)13-4-1-2-5-17(13)26(19,22)23/h1-2,4-7,10H,3,8-9,11H2 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 510 | 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 | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM47995
(2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-ket...)Show SMILES O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C18H15NO6S/c20-14(12-6-7-15-16(10-12)25-9-3-8-24-15)11-19-18(21)13-4-1-2-5-17(13)26(19,22)23/h1-2,4-7,10H,3,8-9,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 816 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center
Curated by PubChem BioAssay
| Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS... |
PubChem Bioassay (2009)
BindingDB Entry DOI: 10.7270/Q25T3HXW |
More data for this
Ligand-Target Pair | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM47995
(2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-ket...)Show SMILES O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C18H15NO6S/c20-14(12-6-7-15-16(10-12)25-9-3-8-24-15)11-19-18(21)13-4-1-2-5-17(13)26(19,22)23/h1-2,4-7,10H,3,8-9,11H2 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 8.63E+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 | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM47995
(2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-ket...)Show SMILES O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C18H15NO6S/c20-14(12-6-7-15-16(10-12)25-9-3-8-24-15)11-19-18(21)13-4-1-2-5-17(13)26(19,22)23/h1-2,4-7,10H,3,8-9,11H2 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 8.63E+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 | |
Heat shock factor protein 1
(Mus musculus) | BDBM47995
(2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-ket...)Show SMILES O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2OCCCOc2c1 Show InChI InChI=1S/C18H15NO6S/c20-14(12-6-7-15-16(10-12)25-9-3-8-24-15)11-19-18(21)13-4-1-2-5-17(13)26(19,22)23/h1-2,4-7,10H,3,8-9,11H2 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | n/a | n/a | <160 | 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 | |