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BDBM51089 (E)-3-[(3Z)-3-(4-chlorobenzylidene)-2-morpholino-cyclopenten-1-yl]-2-cyano-N-(2-fluorophenyl)acrylamide::(E)-3-[(3Z)-3-[(4-chlorophenyl)methylidene]-2-(4-morpholinyl)-1-cyclopentenyl]-2-cyano-N-(2-fluorophenyl)-2-propenamide::(E)-3-[(3Z)-3-[(4-chlorophenyl)methylidene]-2-morpholin-4-yl-cyclopenten-1-yl]-2-cyano-N-(2-fluorophenyl)prop-2-enamide::(E)-3-[(3Z)-3-[(4-chlorophenyl)methylidene]-2-morpholin-4-ylcyclopenten-1-yl]-2-cyano-N-(2-fluorophenyl)prop-2-enamide::MLS000390081::SMR000259345::cid_15945072

SMILES: Fc1ccccc1NC(=O)C(=C\C1=C(N2CCOCC2)\C(\CC1)=C/c1ccc(Cl)cc1)\C#N

InChI Key: InChIKey=WYIWEKXQKQANMX-VYBCSWDBSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 51089   
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
BZLF2


(Human herpesvirus 4 type 2)
BDBM51089
PNG
((E)-3-[(3Z)-3-(4-chlorobenzylidene)-2-morpholino-c...)
Show SMILES Fc1ccccc1NC(=O)C(=C\C1=C(N2CCOCC2)\C(\CC1)=C/c1ccc(Cl)cc1)\C#N
Show InChI InChI=1S/C26H23ClFN3O2/c27-22-9-5-18(6-10-22)15-19-7-8-20(25(19)31-11-13-33-14-12-31)16-21(17-29)26(32)30-24-4-2-1-3-23(24)28/h1-6,9-10,15-16H,7-8,11-14H2,(H,30,32)/b19-15-,21-16+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

n/an/a 6.59E+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
26S Proteasome regulatory subunit Rpn11 (Rpn11)


(Homo sapiens (Human))
BDBM51089
PNG
((E)-3-[(3Z)-3-(4-chlorobenzylidene)-2-morpholino-c...)
Show SMILES Fc1ccccc1NC(=O)C(=C\C1=C(N2CCOCC2)\C(\CC1)=C/c1ccc(Cl)cc1)\C#N
Show InChI InChI=1S/C26H23ClFN3O2/c27-22-9-5-18(6-10-22)15-19-7-8-20(25(19)31-11-13-33-14-12-31)16-21(17-29)26(32)30-24-4-2-1-3-23(24)28/h1-6,9-10,15-16H,7-8,11-14H2,(H,30,32)/b19-15-,21-16+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

n/an/a 6.46E+3n/an/an/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, La Jolla, CA...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2PC30Z9
More data for this
Ligand-Target Pair
Thrombin


(Bos taurus (Bovine))
BDBM51089
PNG
((E)-3-[(3Z)-3-(4-chlorobenzylidene)-2-morpholino-c...)
Show SMILES Fc1ccccc1NC(=O)C(=C\C1=C(N2CCOCC2)\C(\CC1)=C/c1ccc(Cl)cc1)\C#N
Show InChI InChI=1S/C26H23ClFN3O2/c27-22-9-5-18(6-10-22)15-19-7-8-20(25(19)31-11-13-33-14-12-31)16-21(17-29)26(32)30-24-4-2-1-3-23(24)28/h1-6,9-10,15-16H,7-8,11-14H2,(H,30,32)/b19-15-,21-16+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

n/an/a 1.70E+4n/an/an/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, La Jolla, CA...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2JM286J
More data for this
Ligand-Target Pair