BDBM50531927 CHEMBL4476697

SMILES Oc1cc(ccc1NC(=S)NC(=O)c1ccc(cc1)[N+]([O-])=O)[N+]([O-])=O

InChI Key InChIKey=IEZFSMIWEFOJSW-UHFFFAOYSA-N

Data  9 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50531927   

TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  1.90E+3nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over 5 minsMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  3.30E+3nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 R51A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  3.40E+3nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 S55A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  3.90E+3nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 S50A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over 5...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  4.60E+3nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 D277A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  2.44E+4nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 R302A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  3.79E+4nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 N275A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  8.75E+4nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 T278A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetFructose-bisphosphate aldolase class 2(Synechocystis sp. (strain PCC 6803 / Kazusa))
International Cooperation Base Of Pesticide And Green Synthesis (Hubei)

Curated by ChEMBL
LigandPNGBDBM50531927(CHEMBL4476697)
Affinity DataKi:  1.44E+5nMAssay Description:Inhibition of recombinant Synechocystis sp. PCC 6803 FBA2 R281A mutant expressed in Escherichia coli BL21 (DE3) using FBP as substrate measured over ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed