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BDBM185857 US9163007, 197

SMILES: NC1CCN(CC1)C(=O)c1c(nnn1Cc1ccccc1)-c1ccc2[nH]ncc2c1

InChI Key: InChIKey=WQBNSUXFVJXQCA-UHFFFAOYSA-N

Data: 1 KI

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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 = 185857   
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))
BDBM185857
PNG
(US9163007, 197)
Show SMILES NC1CCN(CC1)C(=O)c1c(nnn1Cc1ccccc1)-c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C22H23N7O/c23-18-8-10-28(11-9-18)22(30)21-20(16-6-7-19-17(12-16)13-24-25-19)26-27-29(21)14-15-4-2-1-3-5-15/h1-7,12-13,18H,8-11,14,23H2,(H,24,25)
PDB

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Similars

US Patent
1.23E+3n/an/an/an/an/an/a7.5n/a



AbbVie Inc.

US Patent


Assay Description
6 data point. Cdc7 kinase assays were carried out in 25 mM HEPES, pH 7.5, 1 mM DTT, 10 mM MgCl2, 100 μM Na3VO4, and 0.075 mg/ml Triton X-100 us...


US Patent US9163007 (2015)


BindingDB Entry DOI: 10.7270/Q2KW5DTG
More data for this
Ligand-Target Pair