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BDBM50298341 CHEMBL564497::N-(3-m-tolyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propionamide

SMILES: CCC(=O)Nc1nn2c(nnc2s1)-c1cccc(C)c1

InChI Key: InChIKey=IMLISPBCIBHDCW-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50298341   
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
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50298341
PNG
(CHEMBL564497 | N-(3-m-tolyl-[1,2,4]triazolo[3,4-b]...)
Show SMILES CCC(=O)Nc1nn2c(nnc2s1)-c1cccc(C)c1
Show InChI InChI=1S/C13H13N5OS/c1-3-10(19)14-12-17-18-11(15-16-13(18)20-12)9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3,(H,14,17,19)
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.22E+3n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair