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) | BDBM55902
((5S)-4-[2-(3,4-dichlorophenyl)ethyl]-1-[(1R)-5-[me...)Show SMILES CN(CCCC[C@H](CNCc1ccc(cc1)-c1ccccc1)N1C[C@@H](N(CCc2ccc(Cl)c(Cl)c2)C(=O)C1=O)c1ccccc1)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C51H52Cl2N4O2/c1-55(36-40-22-27-44(28-23-40)42-15-7-3-8-16-42)31-12-11-19-46(35-54-34-39-20-25-43(26-21-39)41-13-5-2-6-14-41)57-37-49(45-17-9-4-10-18-45)56(50(58)51(57)59)32-30-38-24-29-47(52)48(53)33-38/h2-10,13-18,20-29,33,46,49,54H,11-12,19,30-32,34-37H2,1H3/t46-,49-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| 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 | |
X-box-binding protein 1
(Homo sapiens (Human)) | BDBM55902
((5S)-4-[2-(3,4-dichlorophenyl)ethyl]-1-[(1R)-5-[me...)Show SMILES CN(CCCC[C@H](CNCc1ccc(cc1)-c1ccccc1)N1C[C@@H](N(CCc2ccc(Cl)c(Cl)c2)C(=O)C1=O)c1ccccc1)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C51H52Cl2N4O2/c1-55(36-40-22-27-44(28-23-40)42-15-7-3-8-16-42)31-12-11-19-46(35-54-34-39-20-25-43(26-21-39)41-13-5-2-6-14-41)57-37-49(45-17-9-4-10-18-45)56(50(58)51(57)59)32-30-38-24-29-47(52)48(53)33-38/h2-10,13-18,20-29,33,46,49,54H,11-12,19,30-32,34-37H2,1H3/t46-,49-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| 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 | |
DNA damage-inducible transcript 3 protein
(Mus musculus) | BDBM55902
((5S)-4-[2-(3,4-dichlorophenyl)ethyl]-1-[(1R)-5-[me...)Show SMILES CN(CCCC[C@H](CNCc1ccc(cc1)-c1ccccc1)N1C[C@@H](N(CCc2ccc(Cl)c(Cl)c2)C(=O)C1=O)c1ccccc1)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C51H52Cl2N4O2/c1-55(36-40-22-27-44(28-23-40)42-15-7-3-8-16-42)31-12-11-19-46(35-54-34-39-20-25-43(26-21-39)41-13-5-2-6-14-41)57-37-49(45-17-9-4-10-18-45)56(50(58)51(57)59)32-30-38-24-29-47(52)48(53)33-38/h2-10,13-18,20-29,33,46,49,54H,11-12,19,30-32,34-37H2,1H3/t46-,49-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| 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 | |
Neutrophil cytosol factor 1 [S99G]
(Homo sapiens (Human)) | BDBM55902
((5S)-4-[2-(3,4-dichlorophenyl)ethyl]-1-[(1R)-5-[me...)Show SMILES CN(CCCC[C@H](CNCc1ccc(cc1)-c1ccccc1)N1C[C@@H](N(CCc2ccc(Cl)c(Cl)c2)C(=O)C1=O)c1ccccc1)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C51H52Cl2N4O2/c1-55(36-40-22-27-44(28-23-40)42-15-7-3-8-16-42)31-12-11-19-46(35-54-34-39-20-25-43(26-21-39)41-13-5-2-6-14-41)57-37-49(45-17-9-4-10-18-45)56(50(58)51(57)59)32-30-38-24-29-47(52)48(53)33-38/h2-10,13-18,20-29,33,46,49,54H,11-12,19,30-32,34-37H2,1H3/t46-,49-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| 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 | |