BDBM50133952 (S)-2-((3aS,6S,6aR)-4-Benzothiazol-2-yl-6-methyl-5-oxo-hexahydro-pyrrolo[3,2-b]pyrrole-1-carbonyl)-pyrrolidine-1-carboxylic acid (4-isopropyl-phenyl)-amide::CHEMBL344656

SMILES CC(C)c1ccc(NC(=O)N2CCC[C@H]2C(=O)N2CC[C@H]3[C@H]2[C@H](C)C(=O)N3c2nc3ccccc3s2)cc1

InChI Key InChIKey=WTZRHKMMAVQPDV-ZDKQOFBKSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50133952   

TargetCapsid scaffolding protein(Human cytomegalovirus (strain AD169) (HHV-5) (Huma...)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50133952((S)-2-((3aS,6S,6aR)-4-Benzothiazol-2-yl-6-methyl-5...)
Affinity DataKi:  10nMAssay Description:Potency against human cytomegalovirus protease in HCMV pNA assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50133952((S)-2-((3aS,6S,6aR)-4-Benzothiazol-2-yl-6-methyl-5...)
Affinity DataIC50: >1.00E+5nMAssay Description:Concentration required to inhibit AcetylcholinesteraseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCapsid scaffolding protein(Human cytomegalovirus (strain AD169) (HHV-5) (Huma...)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50133952((S)-2-((3aS,6S,6aR)-4-Benzothiazol-2-yl-6-methyl-5...)
Affinity DataIC50:  180nMAssay Description:Inhibition of human cytomegalovirus protease in HCMV pNA assay.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50133952((S)-2-((3aS,6S,6aR)-4-Benzothiazol-2-yl-6-methyl-5...)
Affinity DataIC50: >2.00E+5nMAssay Description:Concentration required to inhibit thrombinMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed