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BDBM50121847 CHEMBL3617132

SMILES: COc1cc(OC)cc(\C=C\C(=N/O)\c2cc3ccccc3cc2O)c1

InChI Key: InChIKey=DXTLPYQRXVCXMB-SMHSOALZSA-N

Data: 1 KI  1 IC50

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 2 hits for monomerid = 50121847   
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
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50121847
PNG
(CHEMBL3617132)
Show SMILES COc1cc(OC)cc(\C=C\C(=N/O)\c2cc3ccccc3cc2O)c1
Show InChI InChI=1S/C21H19NO4/c1-25-17-9-14(10-18(13-17)26-2)7-8-20(22-24)19-11-15-5-3-4-6-16(15)12-21(19)23/h3-13,23-24H,1-2H3/b8-7+,22-20+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.86E+4n/an/an/an/an/an/an/an/a



University of Technology Sydney

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase assessed as reduction in L-DOPA oxidase activity using L-DOPA substrate at 5 uM by Dixon plot


Bioorg Med Chem Lett 25: 4085-91 (2015)


BindingDB Entry DOI: 10.7270/Q2P270ZQ
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50121847
PNG
(CHEMBL3617132)
Show SMILES COc1cc(OC)cc(\C=C\C(=N/O)\c2cc3ccccc3cc2O)c1
Show InChI InChI=1S/C21H19NO4/c1-25-17-9-14(10-18(13-17)26-2)7-8-20(22-24)19-11-15-5-3-4-6-16(15)12-21(19)23/h3-13,23-24H,1-2H3/b8-7+,22-20+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 5.29E+4n/an/an/an/an/an/a



University of Technology Sydney

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase assessed as reduction in L-DOPA oxidase activity using L-DOPA substrate


Bioorg Med Chem Lett 25: 4085-91 (2015)


BindingDB Entry DOI: 10.7270/Q2P270ZQ
More data for this
Ligand-Target Pair