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BDBM50000113 CHEMBL3228352

SMILES: CN1CCSC1=N

InChI Key: InChIKey=YBQSXVIUCDNVNV-UHFFFAOYSA-N

Data: 2 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 = 50000113   
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
Indolethylamine N-methyltransferase


(Homo sapiens)
BDBM50000113
PNG
(CHEMBL3228352)
Show SMILES CN1CCSC1=N
Show InChI InChI=1S/C4H8N2S.HI/c1-6-2-3-7-4(6)5;/h5H,2-3H2,1H3;1H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human lung INMT using N-methyltryptamine as substrate after 60 to 90 mins by liquid scintillation counting in presence of S-methyl-[14C...


J Med Chem 22: 237-47 (1979)


Article DOI: 10.1021/jm00189a004
BindingDB Entry DOI: 10.7270/Q28S4RFG
More data for this
Ligand-Target Pair
Indolethylamine N-methyltransferase


(Oryctolagus cuniculus)
BDBM50000113
PNG
(CHEMBL3228352)
Show SMILES CN1CCSC1=N
Show InChI InChI=1S/C4H8N2S.HI/c1-6-2-3-7-4(6)5;/h5H,2-3H2,1H3;1H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 800n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of New Zealand white rabbit lung INMT using N-methyltryptamine as substrate after 60 to 90 mins by liquid scintillation counting in presen...


J Med Chem 22: 237-47 (1979)


Article DOI: 10.1021/jm00189a004
BindingDB Entry DOI: 10.7270/Q28S4RFG
More data for this
Ligand-Target Pair