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PDB code 2PMN

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Putative uncharacterized protein pk7

  (316/316 = 100%)
(Plasmodium falciparum)
BDBM50264942
PNG
((S)-4-(6-(1-hydroxy-3-methylbutan-2-ylamino)imidaz...)
Show SMILES CC(C)[C@@H](CO)Nc1ccc2ncc(-c3ccc(cc3)C#N)n2n1 |r|
Show InChI InChI=1/C18H19N5O/c1-12(2)15(11-24)21-17-7-8-18-20-10-16(23(18)22-17)14-5-3-13(9-19)4-6-14/h3-8,10,12,15,24H,11H2,1-2H3,(H,21,22)/t15-/s2
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KEGG

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PC cid
PC sid
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Similars

AffyNet 
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PDB
Article
PubMed
n/an/a 280n/an/an/an/an/an/a



MRC Technology

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum PK7


Bioorg Med Chem Lett 18: 5294-8 (2008)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output