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BDBM51055 (E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrrolidin-1-yl-phenyl)prop-2-enamide::(E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrrolidin-1-ylphenyl)prop-2-enamide::(E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrrolidino-phenyl)acrylamide::(E)-2-cyano-N-(2-methoxyphenyl)-3-[5-nitro-2-(1-pyrrolidinyl)phenyl]-2-propenamide::MLS000409077::SMR000264073::cid_5917350

SMILES: COc1ccccc1NC(=O)C(=C\c1cc(ccc1N1CCCC1)[N+]([O-])=O)\C#N

InChI Key: InChIKey=OUUMZOOASRSWGE-FOWTUZBSSA-N

Data: 1 IC50  3 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 51055   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glycoprotein 42


(Human herpesvirus 4 type 2)
BDBM51055
PNG
((E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrro...)
Show SMILES COc1ccccc1NC(=O)C(=C\c1cc(ccc1N1CCCC1)[N+]([O-])=O)\C#N
Show InChI InChI=1S/C21H20N4O4/c1-29-20-7-3-2-6-18(20)23-21(26)16(14-22)12-15-13-17(25(27)28)8-9-19(15)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)/b16-12+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 4.95E+3n/an/an/an/an/an/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: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair
Corticotropin-releasing factor-binding protein


(Homo sapiens (Human))
BDBM51055
PNG
((E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrro...)
Show SMILES COc1ccccc1NC(=O)C(=C\c1cc(ccc1N1CCCC1)[N+]([O-])=O)\C#N
Show InChI InChI=1S/C21H20N4O4/c1-29-20-7-3-2-6-18(20)23-21(26)16(14-22)12-15-13-17(25(27)28)8-9-19(15)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)/b16-12+
KEGG

UniProtKB/SwissProt

antibodypedia
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UniChem
PCBioAssay
n/an/an/an/a 7.66E+3n/an/an/an/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 (2012)


BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair
Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM51055
PNG
((E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrro...)
Show SMILES COc1ccccc1NC(=O)C(=C\c1cc(ccc1N1CCCC1)[N+]([O-])=O)\C#N
Show InChI InChI=1S/C21H20N4O4/c1-29-20-7-3-2-6-18(20)23-21(26)16(14-22)12-15-13-17(25(27)28)8-9-19(15)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)/b16-12+
KEGG

UniProtKB/SwissProt

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n/an/an/an/a 4.59E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
POsterior Segregation


(Caenorhabditis elegans)
BDBM51055
PNG
((E)-2-cyano-N-(2-methoxyphenyl)-3-(5-nitro-2-pyrro...)
Show SMILES COc1ccccc1NC(=O)C(=C\c1cc(ccc1N1CCCC1)[N+]([O-])=O)\C#N
Show InChI InChI=1S/C21H20N4O4/c1-29-20-7-3-2-6-18(20)23-21(26)16(14-22)12-15-13-17(25(27)28)8-9-19(15)24-10-4-5-11-24/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,23,26)/b16-12+
PDB

KEGG

UniProtKB/TrEMBL

GoogleScholar
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PC cid
PC sid
UniChem
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n/an/an/an/a 7.27E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair