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BDBM50024843 2-Amino-1,2,3,4-tetrahydro-1,4-methano-naphthalene-6,7-diol::CHEMBL61595

SMILES: N[C@@H]1CC2CC1c1cc(O)c(O)cc21

InChI Key: InChIKey=QPAZOFORCJMYGG-NWAXUVLPSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50024843   
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
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50024843
PNG
(2-Amino-1,2,3,4-tetrahydro-1,4-methano-naphthalene...)
Show SMILES N[C@@H]1CC2CC1c1cc(O)c(O)cc21 |TLB:0:1:6.13:4,THB:7:6:4:1.2,12:13:4:1.2|
Show InChI InChI=1S/C11H13NO2/c12-9-2-5-1-8(9)7-4-11(14)10(13)3-6(5)7/h3-5,8-9,13-14H,1-2,12H2/t5?,8?,9-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.87E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested in vitro inhibition of phenylethanolamine N-methyl-transferase (PNMT) activity using radiochemical assay


J Med Chem 29: 1972-82 (1986)


BindingDB Entry DOI: 10.7270/Q2K64JNM
More data for this
Ligand-Target Pair
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50024843
PNG
(2-Amino-1,2,3,4-tetrahydro-1,4-methano-naphthalene...)
Show SMILES N[C@@H]1CC2CC1c1cc(O)c(O)cc21 |TLB:0:1:6.13:4,THB:7:6:4:1.2,12:13:4:1.2|
Show InChI InChI=1S/C11H13NO2/c12-9-2-5-1-8(9)7-4-11(14)10(13)3-6(5)7/h3-5,8-9,13-14H,1-2,12H2/t5?,8?,9-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.87E+5n/an/an/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
In vitro inhibition of bovine phenylethylamine N-methyl-transferase (PNMT) using radiochemical assay.


J Med Chem 30: 2208-16 (1988)


BindingDB Entry DOI: 10.7270/Q2CC119N
More data for this
Ligand-Target Pair