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BDBM50281385 CHEMBL4173454

SMILES: CCC[C@@H](CCO)Nc1nc(N)nc2cccc(F)c12

InChI Key: InChIKey=CQNPXNLSGSIGBS-VIFPVBQESA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50281385   
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
1,3-beta-glucan synthase component GLS2


(Saccharomyces cerevisiae)		BDBM50281385
PNG
(CHEMBL4173454)
Show SMILES CCC[C@@H](CCO)Nc1nc(N)nc2cccc(F)c12 |r|
Show InChI InChI=1S/C14H19FN4O/c1-2-4-9(7-8-20)17-13-12-10(15)5-3-6-11(12)18-14(16)19-13/h3,5-6,9,20H,2,4,7-8H2,1H3,(H3,16,17,18,19)/t9-/m0/s1
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 8.90E+3n/an/an/an/an/an/a



Janssen Infectious Diseases-Diagnostics BVBA

Curated by ChEMBL


Assay Description
Inhibition of radioligand binding to human ERG expressed in HEK293 cell membranes by scintillation counting method

J Med Chem 61: 6236-6246 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00643
BindingDB Entry DOI: 10.7270/Q2057JFF
More data for this
Ligand-Target Pair