BDBM50335523 (6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7R)-3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-hydroxyimino-acetylamino]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7R)-3-Acetoxymethyl-7-{2-(2-amino-thiazol-4-yl)-2-[(E)-methoxyimino]-acetylamino}-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7R)-3-Acetoxymethyl-7-{2-(2-amino-thiazol-4-yl)-2-[(Z)-methoxyimino]-acetylamino}-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7R,E)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7R,Z)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7R,Z)-3-(acetoxymethyl)-7-(2-(5-aminothiophen-3-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6R,7S,Z)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(6S,7S,E)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(Cefotaxime)3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-methoxyimino-acetylamino]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::(R)-3-Acetoxymethyl-7-{2-(2-amino-thiazol-4-yl)-2-[(E)-methoxyimino]-acetylamino}-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-methoxyimino-acetylamino]-5,8-dioxo-5lambda*4*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-methoxyimino-acetylamino]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid::3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-methoxyimino-acetylamino]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid (Cefotaxime)::3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-methoxyimino-acetylamino]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid anion::3-Acetoxymethyl-7-[2-(2-amino-thiazol-4-yl)-2-methoxyimino-acetylamino]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid(Cefotaxime)::3-Acetoxymethyl-7-{2-(2-amino-thiazol-4-yl)-2-[(Z)-methoxyimino]-acetylamino}-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid anion::CHEMBL102::Cefotax::Claforan::Kefotex::cefotaxim::cefotaxime

SMILES CO\N=C(\C(=O)N[C@H]1[C@H]2SCC(COC(C)=O)=C(N2C1=O)C(O)=O)c1csc(N)n1

InChI Key InChIKey=GPRBEKHLDVQUJE-VINNURBNSA-N

Data  9 KI  2 IC50  2 Kd  1 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 50335523   

TargetSolute carrier family 22 member 8(Human)
Kyorin University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  290nMAssay Description:TP_TRANSPORTER: inhibition of Estrone sulfate uptake in OAT3-expressing S2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-lactamase(Acinetobacter baumannii)
Paris-Sud University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  500nMAssay Description:Activity of Acinetobacter baumannii ADC-33 beta-lactamaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-lactamase(Acinetobacter baumannii)
Paris-Sud University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  2.50E+3nMAssay Description:Activity of Acinetobacter baumannii ADC-11 beta-lactamaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 22 member 6(Human)
Kyorin University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  3.13E+3nMAssay Description:TP_TRANSPORTER: inhibition of PAH uptake in OAT1-expressing S2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 22 member 11(Human)
Kyorin University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  6.15E+3nMAssay Description:TP_TRANSPORTER: inhibition of Estrone sulfate uptake in OAT4-expressing S2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 15 member 2(Rat)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  2.00E+7nMAssay Description:TP_TRANSPORTER: inhibition of Gly-Sar uptake (pH6.0) in SKPT cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 15 member 2(Human)
University of Milan

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi:  2.00E+7nMAssay Description:Binding affinity to human PepT2 in SKTP cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 15 member 1(Human)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi: >3.00E+7nMAssay Description:TP_TRANSPORTER: inhibition of Gly-Sar uptake (pH6.0) in Caco-2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 15 member 1(Human)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKi: >3.00E+7nMAssay Description:Binding affinity against membrane transport protein PEPT1 in human Caco-2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAlbumin(Human)
Cnrs-Cpbs/Umr 5236

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
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

TargetSolute carrier family 22 member 7(Rat)
Kyorin University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataIC50: >5.00E+6nMAssay Description:TP_TRANSPORTER: inhibition of PGF2alpha in OAT2-S2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetSolute carrier family 22 member 7(Human)
Kyorin University

Curated by ChEMBL
LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataIC50:  4.68E+6nMAssay Description:TP_TRANSPORTER: inhibition of PGF2alpha in OAT2-S2 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetN-acetyltransferase domain-containing protein(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
University of Virginia

LigandPNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
Affinity DataKd:  3.50E+3nMpH: 7.5 T: 25°CAssay Description:Isothermal titration calorimetry (ITC) measurements were performed at 25 °C using an iTC200 calorimeter (MicroCal). Preparations of purified pr...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50335523   

CellGcn5-related N-acetyltransferases (GNAT) superfamily protein PA4794 (PA4794)(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
University of Virginia

SyringePNGBDBM50335523((6R,7R)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-y...)
ITC DataΔG°: -7.44kcal/mole −TΔS°: 1.27kcal/mole ΔH°: -8.71kcal/mole logk: 2.89E+5
pH: 7.5 T: 25.00°C 
In DepthDetails ArticlePubMed