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BDBM27442 11,13-dimethyl-N-phenyl-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-amine::pyrido-thieno-pyrimidine, 6p

SMILES: Cc1cc(C)c2c(n1)sc1c(Nc3ccccc3)ncnc21

InChI Key: InChIKey=HXUSRHQGLBONAF-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 27442   
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
Cdc7 Kinase


(Homo sapiens (Human))
BDBM27442
PNG
(11,13-dimethyl-N-phenyl-8-thia-3,5,10-triazatricyc...)
Show SMILES Cc1cc(C)c2c(n1)sc1c(Nc3ccccc3)ncnc21
Show InChI InChI=1S/C17H14N4S/c1-10-8-11(2)20-17-13(10)14-15(22-17)16(19-9-18-14)21-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,18,19,21)
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Similars

Article
PubMed
>3.00E+3>-7.83>3.00E+4n/an/an/an/a7.537



Roche



Assay Description
The assay was carried out in the reaction buffer containing Cdc7/Dbf4, His6-MCM2, and ATP/[gamma-33P]ATP in the presence of test compounds. After inc...


Bioorg Med Chem Lett 19: 319-23 (2009)


Article DOI: 10.1016/j.bmcl.2008.11.093
BindingDB Entry DOI: 10.7270/Q20G3HG2
More data for this
Ligand-Target Pair