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SMILES: CN1CCN(Cc2c[nH]c3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc23)CC1

InChI Key: InChIKey=VSLDKPAIVWRXRV-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 3 hits for monomerid = 286077   
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
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286077
PNG
(1-Benzyl-N-(3-((4-methylpiperazin-1-yl)methyl)-1H-...)
Show SMILES CN1CCN(Cc2c[nH]c3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc23)CC1
Show InChI InChI=1S/C25H28N6O/c1-29-9-11-30(12-10-29)17-20-14-26-24-13-22(7-8-23(20)24)28-25(32)21-15-27-31(18-21)16-19-5-3-2-4-6-19/h2-8,13-15,18,26H,9-12,16-17H2,1H3,(H,28,32)
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286077
PNG
(1-Benzyl-N-(3-((4-methylpiperazin-1-yl)methyl)-1H-...)
Show SMILES CN1CCN(Cc2c[nH]c3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc23)CC1
Show InChI InChI=1S/C25H28N6O/c1-29-9-11-30(12-10-29)17-20-14-26-24-13-22(7-8-23(20)24)28-25(32)21-15-27-31(18-21)16-19-5-3-2-4-6-19/h2-8,13-15,18,26H,9-12,16-17H2,1H3,(H,28,32)
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UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)

More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286077
PNG
(1-Benzyl-N-(3-((4-methylpiperazin-1-yl)methyl)-1H-...)
Show SMILES CN1CCN(Cc2c[nH]c3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc23)CC1
Show InChI InChI=1S/C25H28N6O/c1-29-9-11-30(12-10-29)17-20-14-26-24-13-22(7-8-23(20)24)28-25(32)21-15-27-31(18-21)16-19-5-3-2-4-6-19/h2-8,13-15,18,26H,9-12,16-17H2,1H3,(H,28,32)
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair