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BDBM50157760 CHEMBL438659::N2',N6'-bis(2-hydroxybenzylidene)pyridine-2,6-dicarbohydrazide

SMILES: Oc1ccccc1C=NNC(=O)c1cccc(n1)C(=O)NN=Cc1ccccc1O

InChI Key: InChIKey=KEBDPIKQAMFVSI-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50157760   
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
Falcipain-2


(Plasmodium falciparum)
BDBM50157760
PNG
(CHEMBL438659 | N2',N6'-bis(2-hydroxybenzylidene)py...)
Show SMILES Oc1ccccc1C=NNC(=O)c1cccc(n1)C(=O)NN=Cc1ccccc1O |w:8.9,22.24|
Show InChI InChI=1S/C21H17N5O4/c27-18-10-3-1-6-14(18)12-22-25-20(29)16-8-5-9-17(24-16)21(30)26-23-13-15-7-2-4-11-19(15)28/h1-13,27-28H,(H,25,29)(H,26,30)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum recombinant falcipain-2


J Med Chem 47: 6609-15 (2004)


Article DOI: 10.1021/jm0493717
BindingDB Entry DOI: 10.7270/Q2GT5P0D
More data for this
Ligand-Target Pair
Cysteine protease falcipain-3


(Plasmodium falciparum)
BDBM50157760
PNG
(CHEMBL438659 | N2',N6'-bis(2-hydroxybenzylidene)py...)
Show SMILES Oc1ccccc1C=NNC(=O)c1cccc(n1)C(=O)NN=Cc1ccccc1O |w:8.9,22.24|
Show InChI InChI=1S/C21H17N5O4/c27-18-10-3-1-6-14(18)12-22-25-20(29)16-8-5-9-17(24-16)21(30)26-23-13-15-7-2-4-11-19(15)28/h1-13,27-28H,(H,25,29)(H,26,30)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.05E+4n/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum recombinant falcipain-3


J Med Chem 47: 6609-15 (2004)


Article DOI: 10.1021/jm0493717
BindingDB Entry DOI: 10.7270/Q2GT5P0D
More data for this
Ligand-Target Pair