null

SMILES CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](COCc1ccc(Br)cc1)[C@@H](O)CC(=O)NCCCc1ccccc1

InChI Key InChIKey=JSYKJQOVAIGFCW-XEVVZDEMSA-N

PDB links: 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 7978   

TargetPlasmepsin I(Plasmodium falciparum)
Linkoping University

LigandPNGBDBM7978((3S,4S)-5-[(4-bromophenyl)methoxy]-3-hydroxy-4-[(2...)copy SMILEScopy InChI
Affinity DataKi:  5.40nMAssay Description:Enzyme activities were assayed by monitoring the hydrolysis of substrate in the presence or absence of inhibitor compounds. The hydrolysis was record...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WM1BMGPubMed
TargetPlasmepsin II(Plasmodium falciparum)
Linkoping University

LigandPNGBDBM7978((3S,4S)-5-[(4-bromophenyl)methoxy]-3-hydroxy-4-[(2...)copy SMILEScopy InChI
Affinity DataKi:  30nM ΔG°:  -10.2kcal/molepH: 4.5 T: 2°CAssay Description:Enzyme activities were assayed by monitoring the hydrolysis of substrate in the presence or absence of inhibitor compounds. The hydrolysis was record...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WM1BMGPubMed
TargetCathepsin D(Homo sapiens (Human))
Linkoping University

LigandPNGBDBM7978((3S,4S)-5-[(4-bromophenyl)methoxy]-3-hydroxy-4-[(2...)copy SMILEScopy InChI
Affinity DataKi:  459nMAssay Description:Enzyme activities were assayed by monitoring the hydrolysis of substrate in the presence or absence of inhibitor compounds. The hydrolysis was record...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WM1BMGPubMed