BDBM50350472 640/359::Anaptivan::CEFUROXIME::Ceftin

SMILES CO\N=C(\C(=O)N[C@H]1[C@H]2SCC(COC(N)=O)=C(N2C1=O)C(O)=O)c1ccco1

InChI Key InChIKey=JFPVXVDWJQMJEE-UHFFFAOYSA-N

Data  4 KI  1 Kd  1 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50350472   

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

LigandPNGBDBM50350472(640/359 | Anaptivan | Ceftin | CEFUROXIME)
Affinity DataKd:  1.77E+5nMpH: 7.5 T: 2°CAssay Description:Isothermal titration calorimetry (ITC) measurements were performed at 25 °C using an iTC200 calorimeter (MicroCal). Preparations of purified prot...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetSolute carrier family 15 member 2(Rat)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50350472(640/359 | Anaptivan | Ceftin | CEFUROXIME)
Affinity DataKi: >3.00E+3nMAssay Description:TP_TRANSPORTER: inhibition of Gly-Sar uptake (pH6.0) in SKPT cellsMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetSolute carrier family 15 member 1(Human)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50350472(640/359 | Anaptivan | Ceftin | CEFUROXIME)
Affinity DataKi: >5.00E+6nMAssay Description:TP_TRANSPORTER: inhibition of Gly-Sar uptake (pH6.0) in Caco-2 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetSolute carrier family 15 member 1(Human)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50350472(640/359 | Anaptivan | Ceftin | CEFUROXIME)
Affinity DataKi:  2.60E+7nMAssay Description:TP_TRANSPORTER: inhibition of Gly-Sar uptake (pH6.0) in Caco-2 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetSolute carrier family 15 member 2(Rat)
Biozentrum of The Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50350472(640/359 | Anaptivan | Ceftin | CEFUROXIME)
Affinity DataKi:  1.26E+7nMAssay Description:TP_TRANSPORTER: inhibition of Gly-Sar uptake (pH6.0) in SKPT cellsMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50350472   

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

SyringePNGBDBM50350472(640/359 | Anaptivan | Ceftin | CEFUROXIME)
ITC DataΔG°: -5.12kcal/mole −TΔS°: 3.16kcal/mole ΔH°: -8.28kcal/mole logk: 5.71E+3
pH: 7.5 T: 25.00°C 
In DepthDetails Article
PubMed