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BDBM50383741 CHEMBL2030384

SMILES: Cc1cc2oc3c(nc(CN4CC[C@H](O)C4)[nH]c3=O)c2cc1Br

InChI Key: InChIKey=CGLCQOJIDHILHH-VIFPVBQESA-N

Data: 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 = 50383741   
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
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))
BDBM50383741
PNG
(CHEMBL2030384)
Show SMILES Cc1cc2oc3c(nc(CN4CC[C@H](O)C4)[nH]c3=O)c2cc1Br |r|
Show InChI InChI=1S/C16H16BrN3O3/c1-8-4-12-10(5-11(8)17)14-15(23-12)16(22)19-13(18-14)7-20-3-2-9(21)6-20/h4-5,9,21H,2-3,6-7H2,1H3,(H,18,19,22)/t9-/m0/s1
PDB

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Similars

Article
PubMed
n/an/a 1.04E+5n/an/an/an/an/an/a



Exelixis

Curated by ChEMBL


Assay Description
Inhibition of N-terminus Myc-tagged human CDC7 expressed in Escherichia coli by chemiluminescence assay in presence of ATP


Bioorg Med Chem Lett 22: 3727-31 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.024
BindingDB Entry DOI: 10.7270/Q20C4WS0
More data for this
Ligand-Target Pair