BDBM50422012 Klinomycin::MINOCYCLINE::Minocin::Vectrin

SMILES CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O)N(C)C

InChI Key InChIKey=ZZZRUAITSXLWBH-CSYJEMQYSA-N

Data  2 KI  2 IC50  1 Kd

  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 5 hits for monomerid = 50422012   

TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
University Of South Carolina

Curated by ChEMBL
LigandPNGBDBM50422012(Klinomycin | MINOCYCLINE | Minocin | Vectrin)
Affinity DataKi:  1.80E+5nMAssay Description:Inhibition of PAD4 measured by intercept plot of Lineweaver-Burke analysesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
University Of South Carolina

Curated by ChEMBL
LigandPNGBDBM50422012(Klinomycin | MINOCYCLINE | Minocin | Vectrin)
Affinity DataKi:  5.40E+5nMAssay Description:Inhibition of PAD4 measured by slope plot of Lineweaver-Burke analysesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMultidrug transporter MdfA(Escherichia coli (strain K12))
Tufts University

Curated by ChEMBL
LigandPNGBDBM50422012(Klinomycin | MINOCYCLINE | Minocin | Vectrin)
Affinity DataIC50:  2.60E+3nMAssay Description:Inhibition of [3H]tetracycline uptake into everted membrane vesicles, prepared from tetracycline resistant Escherichia coli D1-209More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
University Of South Carolina

Curated by ChEMBL
LigandPNGBDBM50422012(Klinomycin | MINOCYCLINE | Minocin | Vectrin)
Affinity DataIC50:  6.20E+5nMAssay Description:Inhibition of PAD4 by ABPP-based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlbumin(Homo sapiens (Human))
Cnrs-Cpbs/Umr 5236

Curated by ChEMBL
LigandPNGBDBM50422012(Klinomycin | MINOCYCLINE | Minocin | Vectrin)
Affinity DataKd:  1.20E+4nMAssay Description:Binding affinity to first site on human serum albumin by SPRMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed