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SMILES: Oc1ccccc1C(=O)N\N=C1/C(=O)N(CC(=O)Nc2ccccc2)c2ccccc12

InChI Key: InChIKey=JJQQBBPIFVQYRZ-DAFNUICNSA-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 3 hits for monomerid = 61170   
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
SUMO-conjugating enzyme UBC9


(Homo sapiens (Human))
BDBM61170
PNG
(2-oxidanyl-N-[(Z)-[2-oxidanylidene-1-(2-oxidanylid...)
Show SMILES Oc1ccccc1C(=O)N\N=C1/C(=O)N(CC(=O)Nc2ccccc2)c2ccccc12
Show InChI InChI=1S/C23H18N4O4/c28-19-13-7-5-11-17(19)22(30)26-25-21-16-10-4-6-12-18(16)27(23(21)31)14-20(29)24-15-8-2-1-3-9-15/h1-13,28H,14H2,(H,24,29)(H,26,30)/b25-21-
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PC cid
PC sid
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PCBioAssay
n/an/a 1.51E+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, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2V986G8
More data for this
Ligand-Target Pair
Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1


(Homo sapiens (Human))
BDBM61170
PNG
(2-oxidanyl-N-[(Z)-[2-oxidanylidene-1-(2-oxidanylid...)
Show SMILES Oc1ccccc1C(=O)N\N=C1/C(=O)N(CC(=O)Nc2ccccc2)c2ccccc12
Show InChI InChI=1S/C23H18N4O4/c28-19-13-7-5-11-17(19)22(30)26-25-21-16-10-4-6-12-18(16)27(23(21)31)14-20(29)24-15-8-2-1-3-9-15/h1-13,28H,14H2,(H,24,29)(H,26,30)/b25-21-
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KEGG

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antibodypedia
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 2.00E+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
SUMO-activating enzyme subunit 1


(Homo sapiens (Human))
BDBM61170
PNG
(2-oxidanyl-N-[(Z)-[2-oxidanylidene-1-(2-oxidanylid...)
Show SMILES Oc1ccccc1C(=O)N\N=C1/C(=O)N(CC(=O)Nc2ccccc2)c2ccccc12
Show InChI InChI=1S/C23H18N4O4/c28-19-13-7-5-11-17(19)22(30)26-25-21-16-10-4-6-12-18(16)27(23(21)31)14-20(29)24-15-8-2-1-3-9-15/h1-13,28H,14H2,(H,24,29)(H,26,30)/b25-21-
PDB
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Reactome pathway
KEGG

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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 1.40E+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, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2BP0175
More data for this
Ligand-Target Pair