BDBM50266539 (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide::CHEMBL456066::CHLORTETRACYCLINE::chlorotetracycline

SMILES CN(C)[C@H]1[C@@H]2C[C@H]3C(C(=O)c4c(O)ccc(Cl)c4[C@@]3(C)O)C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O

InChI Key InChIKey=RNPLSXLZRGPQCU-WYOUFOJNSA-N

Data  3 KI  2 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 5 hits for monomerid = 50266539   

TargetP2Y purinoceptor 12(Homo sapiens (Human))
University Of Bonn

Curated by ChEMBL
LigandPNGBDBM50266539((4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,...)
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]PSB0413 from human platelet P2Y12 receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
University Of South Carolina

Curated by ChEMBL
LigandPNGBDBM50266539((4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,...)
Affinity DataKi:  1.10E+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
LigandPNGBDBM50266539((4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,...)
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
TargetcAMP-specific 3',5'-cyclic phosphodiesterase 4A(Homo sapiens (Human))
University Health Network

Curated by ChEMBL
LigandPNGBDBM50266539((4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,...)
Affinity DataIC50:  1.00E+5nMAssay Description:Inhibition of PAD4 (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
University Of South Carolina

Curated by ChEMBL
LigandPNGBDBM50266539((4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,...)
Affinity DataIC50:  1.00E+5nMAssay Description:Inhibition of PAD4 by ABPP-based assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed