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BDBM50139367 2-hydroxybenzaldehyde::CHEMBL108925::Salicylaldehyd::Salizylaldehyd::o-formylphenol::salicylal::salicylaldehyde

SMILES: Oc1ccccc1C=O

InChI Key: InChIKey=SMQUZDBALVYZAC-UHFFFAOYSA-N

Data: 3 IC50

PDB links: 2 PDB IDs match 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 3 hits for monomerid = 50139367   
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
Serine/threonine-protein kinase/endoribonuclease IRE1 Alpha


(Homo sapiens (Human))
BDBM50139367
PNG
(2-hydroxybenzaldehyde | CHEMBL108925 | Salicylalde...)
Show SMILES Oc1ccccc1C=O
Show InChI InChI=1S/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9H
PDB
MMDB

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Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



H. Lee Moffitt Cancer Center and Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human recombinant puritin-His-tagged IRE-1 RNase expressed in SF21 cells using XBP-1 RNA stem loop as substrate incubated for 30 mins p...


J Med Chem 57: 4289-301 (2014)

More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50139367
PNG
(2-hydroxybenzaldehyde | CHEMBL108925 | Salicylalde...)
Show SMILES Oc1ccccc1C=O
Show InChI InChI=1S/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9H
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Article
PubMed
n/an/a 8.33E+5n/an/an/an/an/an/a



Universit£ degli Studi di Cagliari

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase after 10 mins by L-DOPA oxidation assay


Bioorg Med Chem Lett 20: 6138-40 (2010)

More data for this
Ligand-Target Pair
Tyrosinase


(Homo sapiens (Human))
BDBM50139367
PNG
(2-hydroxybenzaldehyde | CHEMBL108925 | Salicylalde...)
Show SMILES Oc1ccccc1C=O
Show InChI InChI=1S/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9H
KEGG

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CHEMBL
KEGG
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UniChem

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PubMed
n/an/a 3.30E+6n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound was evaluated against the oxidation of L-3,4-dihydroxyphenylalanine (L-DOPA) catalyzed by mushroom tyrosinase


Citation and Details
More data for this
Ligand-Target Pair