BDBM50481275 CHEMBL593165::N,N''-Disalicylidenetrimethylenediamine

SMILES Oc1ccccc1\C=N\CCC\N=C\c1ccccc1O

InChI Key InChIKey=KLDZYURQCUYZBL-UHFFFAOYSA-N

Data  4 KI  1 IC50

  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 5 hits for monomerid = 50481275   

Target3-oxoacyl-[acyl-carrier-protein] synthase 3(Escherichia coli)
Nanjing University

Curated by ChEMBL
LigandPNGBDBM50481275(N,N''-Disalicylidenetrimethylenediamine | CHEMBL59...)
Affinity DataIC50: 4.25E+4nMAssay Description:Inhibition of Escherichia coli Beta-ketoacyl-ACP synthase III expressed in Escherichia coli BL21 (DE3) by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
Sapienza University of Rome

Curated by ChEMBL
LigandPNGBDBM50481275(N,N''-Disalicylidenetrimethylenediamine | CHEMBL59...)
Affinity DataKi:  950nMAssay Description:Inhibition of human recombinant carbonic anhydrase 12-mediated CO2 hydration preincubated for 15 mins by stopped-flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Sapienza University of Rome

Curated by ChEMBL
LigandPNGBDBM50481275(N,N''-Disalicylidenetrimethylenediamine | CHEMBL59...)
Affinity DataKi:  4.19E+3nMAssay Description:Inhibition of human recombinant carbonic anhydrase 2-mediated CO2 hydration preincubated for 15 mins by stopped-flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Sapienza University of Rome

Curated by ChEMBL
LigandPNGBDBM50481275(N,N''-Disalicylidenetrimethylenediamine | CHEMBL59...)
Affinity DataKi:  1.57E+4nMAssay Description:Inhibition of human recombinant carbonic anhydrase 9-mediated CO2 hydration preincubated for 15 mins by stopped-flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Sapienza University of Rome

Curated by ChEMBL
LigandPNGBDBM50481275(N,N''-Disalicylidenetrimethylenediamine | CHEMBL59...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human recombinant carbonic anhydrase 1-mediated CO2 hydration preincubated for 15 mins by stopped-flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/2/2020
Entry Details Article
PubMed