BindingDB logo
myBDB logout

null

SMILES: CN1CCN(CC1)C1c2ccccc2Sc2ccccc12

InChI Key: InChIKey=QTSDYZKXMXPDKS-UHFFFAOYSA-N

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 1 hit for monomerid = 50187210   
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
Histone-lysine N-methyltransferase SETD7


(Homo sapiens (Human))		BDBM50187210
PNG
(CHEMBL3827652)
Show SMILES CN1CCN(CC1)C1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C18H20N2S/c1-19-10-12-20(13-11-19)18-14-6-2-4-8-16(14)21-17-9-5-3-7-15(17)18/h2-9,18H,10-13H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Tokyo Medical and Dental University (TMDU)

Curated by ChEMBL


Assay Description
Inhibition of recombinant SET7/9 (unknown origin) using biotinylated histone H3-derived peptide/SAM as substrate after 60 mins by AlphaLISA assay

Bioorg Med Chem 24: 4318-4323 (2016)


BindingDB Entry DOI: 10.7270/Q2959KGV
More data for this
Ligand-Target Pair