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BDBM154570 2-Hydroxyimino-3-phenylpropanoic acid (HIPP)

SMILES: ON=C(Cc1ccccc1)C(O)=O

InChI Key: InChIKey=PNTMGOUAICFJQK-NTMALXAHSA-N

Data: 1 IC50  3 Kd  3 ITC

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 154570   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
C-terminal-binding protein 2 (CtBP2)


(Homo sapiens (Human))
BDBM154570
PNG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
Show SMILES ON=C(Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C9H9NO3/c11-9(12)8(10-13)6-7-4-2-1-3-5-7/h1-5,13H,6H2,(H,11,12)/b10-8-
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a 1.30E+3n/an/an/a8.5n/a



University of Massachusetts Medical School



Assay Description
Purified CtBP2 was dialyzed overnight against 500 mL of 50 mM glycylglycine at pH 8.5, 300 mM NaCl, 1 mM EDTA, and 2 mM TCEP, with or without 1.5 mM ...


ACS Chem Biol 10: 1118-27 (2015)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
C-terminal-binding protein 2 (CtBP2)


(Homo sapiens (Human))
BDBM154570
PNG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
Show SMILES ON=C(Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C9H9NO3/c11-9(12)8(10-13)6-7-4-2-1-3-5-7/h1-5,13H,6H2,(H,11,12)/b10-8-
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 745n/an/an/an/an/an/a



University of Massachusetts Medical School



Assay Description
Purified CtBP2 in 50% glycerol was added to 150 μM NADH and variable amounts of MTOB and HIPP in buffer containing 25 mM HEPES, pH 7.1, 25 mM p...


ACS Chem Biol 10: 1118-27 (2015)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
C-terminal-binding protein 1 (CtBP1)


(Homo sapiens (Human))
BDBM154570
PNG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
Show SMILES ON=C(Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C9H9NO3/c11-9(12)8(10-13)6-7-4-2-1-3-5-7/h1-5,13H,6H2,(H,11,12)/b10-8-
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a 370n/an/an/a7.5n/a



University of Massachusetts Medical School



Assay Description
Purified CtBP2 was dialyzed overnight against 500 mL of 50 mM glycylglycine at pH 8.5, 300 mM NaCl, 1 mM EDTA, and 2 mM TCEP, with or without 1.5 mM ...


ACS Chem Biol 10: 1118-27 (2015)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
C-terminal-binding protein 1 (CtBP1)


(Homo sapiens (Human))
BDBM154570
PNG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
Show SMILES ON=C(Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C9H9NO3/c11-9(12)8(10-13)6-7-4-2-1-3-5-7/h1-5,13H,6H2,(H,11,12)/b10-8-
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a 2.77E+3n/an/an/a8.5n/a



University of Massachusetts Medical School



Assay Description
Purified CtBP2 was dialyzed overnight against 500 mL of 50 mM glycylglycine at pH 8.5, 300 mM NaCl, 1 mM EDTA, and 2 mM TCEP, with or without 1.5 mM ...


ACS Chem Biol 10: 1118-27 (2015)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Activity Spreadsheet -- ITC Data from BindingDB

Found 3 hits for monomerid = 154570
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
C-terminal-binding protein 2 (CtBP2)

(Homo sapiens (Human))
BDBM154570
JPEG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
GoogleScholar
PDB
PC cid
PC sid
PDB
-7.882.10-10.05.888.520



University of Massachusetts Medical School





ACS Chem Biol 10: 1118-27 (2015)

C-terminal-binding protein 1 (CtBP1)

(Homo sapiens (Human))
BDBM154570
JPEG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
GoogleScholar
PDB
PC cid
PC sid
PDB
-7.403.85-11.45.528.520



University of Massachusetts Medical School





ACS Chem Biol 10: 1118-27 (2015)

C-terminal-binding protein 1 (CtBP1)

(Homo sapiens (Human))
BDBM154570
JPEG
(2-Hydroxyimino-3-phenylpropanoic acid (HIPP))
GoogleScholar
PDB
PC cid
PC sid
PDB
-8.608.40-16.76.417.520



University of Massachusetts Medical School





ACS Chem Biol 10: 1118-27 (2015)