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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Subtilisin-like protease 1' and Ligand = 'BDBM50100705'   
Target/Host
(Institution)		LigandTarget/Host
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
Subtilisin-like protease 1


(Plasmodium falciparum)		BDBM50100705
PNG
(CHEMBL3326340)
Show SMILES CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)NC(CCC(O)=O)C(=O)C(=O)NCCC(O)=O |r|
Show InChI InChI=1S/C24H39N5O11/c1-6-11(2)18(27-14(5)31)22(38)29-19(13(4)30)23(39)26-12(3)21(37)28-15(7-8-16(32)33)20(36)24(40)25-10-9-17(34)35/h11-13,15,18-19,30H,6-10H2,1-5H3,(H,25,40)(H,26,39)(H,27,31)(H,28,37)(H,29,38)(H,32,33)(H,34,35)/t11-,12-,13+,15?,18-,19-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Latvian Institute of Organic Synthesis

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum SUB1

Bioorg Med Chem Lett 24: 4486-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.07.086
BindingDB Entry DOI: 10.7270/Q2DJ5HDB
More data for this
Ligand-Target Pair