BDBM50236893 CHEBI:15664::CHEMBL145233

SMILES C\C(CO)=C/COP(O)(=O)OP(O)(O)=O

InChI Key InChIKey=MDSIZRKJVDMQOQ-GORDUTHDSA-N

Data  10 IC50  2 Kd  8 EC50

PDB links: 14 PDB IDs match this monomer.

  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 20 hits for monomerid = 50236893   

TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  1.60nMAssay Description:Activation of BTN3A1 in human Vgamma9Vdelta2 T cells assessed as induction of T effector cells mediated K562 cell lysis preincubated with K562 cells ...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  0.0600nMAssay Description:Binding affinity to BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cellsMore data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  0.0600nMAssay Description:Binding affinity to butyrophilin 3A1 in human Vgamma9/Vdelta2 T-cells assessed as activation of Vgamma9/Vdelta2 T-cells by upregulation of CD69 and C...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  0.510nMAssay Description:Binding affinity to BTN3A1 in human PBMC assessed as stimulation of Vgamma9 Vdelta2 T cells incubated for 3 days and measured after 11 days post comp...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  2.30E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 B30.2 domain (unknown origin) expressed in Escherichia coli BL21 (DE) measured after 60...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataKd:  1.54E+3nMAssay Description:Binding affinity to C-terminal 6His-tagged BTN3A1 full interaction domain (unknown origin) expressed in Escherichia coli BL21 (DE) by isothermal calo...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  0.510nMAssay Description:Activation of BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cells assessed as induction of IL2-stimulated cell proliferation by measuring increase i...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  4.20nMAssay Description:Activation of BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cells assessed as induction of IL2-stimulated IFNgamma production measured after 48 hrs ...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  1.61E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 full interaction domain (unknown origin) expressed in Escherichia coli BL21 (DE) measur...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  1.61E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 full interaction domain (unknown origin) expressed in Escherichia coli BL21 (DE) at pH ...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  1.99E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 full interaction domain (unknown origin) expressed in Escherichia coli BL21 (DE) measur...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  1.61E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 full interaction domain (unknown origin) expressed in Escherichia coli BL21 (DE) measur...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50: >3.33E+5nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 H381R mutant (unknown origin) expressed in Escherichia coli BL21 (DE) measured after 60...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataKd:  4.27E+3nMAssay Description:Binding affinity to C-terminal 6His-tagged BTN3A1 B30.2 domain (unknown origin) expressed in Escherichia coli BL21 (DE) by isothermal calorimetric ti...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  9.64E+3nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 W421A mutant (unknown origin) expressed in Escherichia coli BL21 (DE) measured after 60...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  1.21E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 R442A mutant (unknown origin) expressed in Escherichia coli BL21 (DE) measured after 60...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  4.56E+3nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 R499A mutant (unknown origin) expressed in Escherichia coli BL21 (DE) measured after 60...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataIC50:  1.65E+4nMAssay Description:Displacement of GDP-BODIPY from C-terminal 6His-tagged BTN3A1 R448A mutant (unknown origin) expressed in Escherichia coli BL21 (DE) measured after 60...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  0.145nMAssay Description:Binding affinity to BTN3A1 in human PBMC-derived Vgamma9/Vdelta2 T cells assessed as increase in CD69/CD25 level incubated for overnight by flow cyto...More data for this Ligand-Target Pair
TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
University Of Iowa

Curated by ChEMBL
LigandPNGBDBM50236893(CHEBI:15664 | CHEMBL145233)
Affinity DataEC50:  0.510nMAssay Description:Activation of BTN3A1 in human Vgamma9Vdelta2 T cells assessed as induction of interleukin 2 stimulated cell proliferation treated for 72 hrs measured...More data for this Ligand-Target Pair