BDBM25257 ({hydroxy[(3-methylbut-3-en-1-yl)oxy]phosphoryl}oxy)phosphonic acid::[14C]IPP::[14C]isopentenyl diphosphate

SMILES CC(=C)CCOP(O)(=O)OP(O)(O)=O

InChI Key InChIKey=NUHSROFQTUXZQQ-UHFFFAOYSA-N

Data  1 IC50  3 EC50

PDB links: 60 PDB IDs match this monomer.

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 4 hits for monomerid = 25257   

TargetButyrophilin subfamily 3 member A1(Homo sapiens (Human))
Western Michigan University

Curated by ChEMBL
LigandPNGBDBM25257(({hydroxy[(3-methylbut-3-en-1-yl)oxy]phosphoryl}ox...)
Show SMILES CC(=C)CCOP(O)(=O)OP(O)(O)=O
Show InChI InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h1,3-4H2,2H3,(H,9,10)(H2,6,7,8)
Affinity DataEC50:  7.10E+4nMAssay 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))
Western Michigan University

Curated by ChEMBL
LigandPNGBDBM25257(({hydroxy[(3-methylbut-3-en-1-yl)oxy]phosphoryl}ox...)
Show SMILES CC(=C)CCOP(O)(=O)OP(O)(O)=O
Show InChI InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h1,3-4H2,2H3,(H,9,10)(H2,6,7,8)
Affinity DataEC50:  1.00E+3nMAssay 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))
Western Michigan University

Curated by ChEMBL
LigandPNGBDBM25257(({hydroxy[(3-methylbut-3-en-1-yl)oxy]phosphoryl}ox...)
Show SMILES CC(=C)CCOP(O)(=O)OP(O)(O)=O
Show InChI InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h1,3-4H2,2H3,(H,9,10)(H2,6,7,8)
Affinity DataEC50:  3.60E+4nMAssay 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))
Western Michigan University

Curated by ChEMBL
LigandPNGBDBM25257(({hydroxy[(3-methylbut-3-en-1-yl)oxy]phosphoryl}ox...)
Show SMILES CC(=C)CCOP(O)(=O)OP(O)(O)=O
Show InChI InChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h1,3-4H2,2H3,(H,9,10)(H2,6,7,8)
Affinity DataIC50: 5.13E+5nMAssay 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