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SMILES: Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1

InChI Key: InChIKey=JENMTPUZLVWREN-VMPITWQZSA-N

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 6 hits for monomerid = 82821   
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
Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1


(Homo sapiens (Human))
BDBM82821
PNG
((E)-3-(2-chlorophenyl)-N-(1,3-diketoisoindolin-5-y...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1
Show InChI InChI=1S/C17H11ClN2O3/c18-14-4-2-1-3-10(14)5-8-15(21)19-11-6-7-12-13(9-11)17(23)20-16(12)22/h1-9H,(H,19,21)(H,20,22,23)/b8-5+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.73E+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, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
Prothrombin


(Bos taurus (Bovine))
BDBM82821
PNG
((E)-3-(2-chlorophenyl)-N-(1,3-diketoisoindolin-5-y...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1
Show InChI InChI=1S/C17H11ClN2O3/c18-14-4-2-1-3-10(14)5-8-15(21)19-11-6-7-12-13(9-11)17(23)20-16(12)22/h1-9H,(H,19,21)(H,20,22,23)/b8-5+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 6.16E+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
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM82821
PNG
((E)-3-(2-chlorophenyl)-N-(1,3-diketoisoindolin-5-y...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1
Show InChI InChI=1S/C17H11ClN2O3/c18-14-4-2-1-3-10(14)5-8-15(21)19-11-6-7-12-13(9-11)17(23)20-16(12)22/h1-9H,(H,19,21)(H,20,22,23)/b8-5+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.90E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2DN43N5
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase


(Homo sapiens (Human))
BDBM82821
PNG
((E)-3-(2-chlorophenyl)-N-(1,3-diketoisoindolin-5-y...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1
Show InChI InChI=1S/C17H11ClN2O3/c18-14-4-2-1-3-10(14)5-8-15(21)19-11-6-7-12-13(9-11)17(23)20-16(12)22/h1-9H,(H,19,21)(H,20,22,23)/b8-5+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.58E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2GM85XC
More data for this
Ligand-Target Pair
Low molecular weight phosphotyrosine protein phosphatase


(Homo sapiens (Human))
BDBM82821
PNG
((E)-3-(2-chlorophenyl)-N-(1,3-diketoisoindolin-5-y...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1
Show InChI InChI=1S/C17H11ClN2O3/c18-14-4-2-1-3-10(14)5-8-15(21)19-11-6-7-12-13(9-11)17(23)20-16(12)22/h1-9H,(H,19,21)(H,20,22,23)/b8-5+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2JD4VDZ
More data for this
Ligand-Target Pair
26S proteasome non-ATPase regulatory subunit 14


(Homo sapiens (Human))
BDBM82821
PNG
((E)-3-(2-chlorophenyl)-N-(1,3-diketoisoindolin-5-y...)
Show SMILES Clc1ccccc1\C=C\C(=O)Nc1ccc2C(=O)NC(=O)c2c1
Show InChI InChI=1S/C17H11ClN2O3/c18-14-4-2-1-3-10(14)5-8-15(21)19-11-6-7-12-13(9-11)17(23)20-16(12)22/h1-9H,(H,19,21)(H,20,22,23)/b8-5+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.79E+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/Q2PC30Z9
More data for this
Ligand-Target Pair