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BDBM50028545 7-Methyl-1H-indole-5,6-diol::CHEMBL431031

SMILES: Cc1c(O)c(O)cc2cc[nH]c12

InChI Key: InChIKey=YCBKUMJFPOCXEZ-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50028545   
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
Catechol-O-methyltransferase


(Rattus norvegicus (Rat))
BDBM50028545
PNG
(7-Methyl-1H-indole-5,6-diol | CHEMBL431031)
Show SMILES Cc1c(O)c(O)cc2cc[nH]c12
Show InChI InChI=1S/C9H9NO2/c1-5-8-6(2-3-10-8)4-7(11)9(5)12/h2-4,10-12H,1H3
PDB
MMDB

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PC sid
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Similars

PubMed
1.14E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Kinetic constants for the inactivation of Catechol O-methyltransferase by the compound


J Med Chem 25: 263-71 (1982)


BindingDB Entry DOI: 10.7270/Q2G15ZV0
More data for this
Ligand-Target Pair