Found 4 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) | BDBM55820
(6-methyl-2-[(5-nitro-1-benzothiophen-2-yl)carbonyl...)Show SMILES CN1CCc2c(C1)sc(NC(=O)c1cc3cc(ccc3s1)[N+]([O-])=O)c2C(N)=O Show InChI InChI=1S/C18H16N4O4S2/c1-21-5-4-11-14(8-21)28-18(15(11)16(19)23)20-17(24)13-7-9-6-10(22(25)26)2-3-12(9)27-13/h2-3,6-7H,4-5,8H2,1H3,(H2,19,23)(H,20,24) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 4.80E+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) | BDBM55820
(6-methyl-2-[(5-nitro-1-benzothiophen-2-yl)carbonyl...)Show SMILES CN1CCc2c(C1)sc(NC(=O)c1cc3cc(ccc3s1)[N+]([O-])=O)c2C(N)=O Show InChI InChI=1S/C18H16N4O4S2/c1-21-5-4-11-14(8-21)28-18(15(11)16(19)23)20-17(24)13-7-9-6-10(22(25)26)2-3-12(9)27-13/h2-3,6-7H,4-5,8H2,1H3,(H2,19,23)(H,20,24) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
PC cid
PC sid
UniChem
Similars
| PCBioAssay
| n/a | n/a | 4.80E+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 | |
X-box-binding protein 1
(Homo sapiens (Human)) | BDBM55820
(6-methyl-2-[(5-nitro-1-benzothiophen-2-yl)carbonyl...)Show SMILES CN1CCc2c(C1)sc(NC(=O)c1cc3cc(ccc3s1)[N+]([O-])=O)c2C(N)=O Show InChI InChI=1S/C18H16N4O4S2/c1-21-5-4-11-14(8-21)28-18(15(11)16(19)23)20-17(24)13-7-9-6-10(22(25)26)2-3-12(9)27-13/h2-3,6-7H,4-5,8H2,1H3,(H2,19,23)(H,20,24) | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
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/Q2NK3CGB |
More data for this
Ligand-Target Pair | |
Neutrophil cytosol factor 1 [S99G]
(Homo sapiens (Human)) | BDBM55820
(6-methyl-2-[(5-nitro-1-benzothiophen-2-yl)carbonyl...)Show SMILES CN1CCc2c(C1)sc(NC(=O)c1cc3cc(ccc3s1)[N+]([O-])=O)c2C(N)=O Show InChI InChI=1S/C18H16N4O4S2/c1-21-5-4-11-14(8-21)28-18(15(11)16(19)23)20-17(24)13-7-9-6-10(22(25)26)2-3-12(9)27-13/h2-3,6-7H,4-5,8H2,1H3,(H2,19,23)(H,20,24) | 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 | |