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BDBM386060 4-(4-(1-(4-chloro-3-fluorophenyl)-2-(piperidin-1-yl)ethyl)piperazin-1-yl)-7,8-dihydropteridin-6(5H)-one::US10287300, Compound A62

SMILES: Fc1cc(ccc1Cl)C(CN1CCCCC1)N1CCN(CC1)c1ncnc2NCC(=O)Nc12

InChI Key: InChIKey=VWDMCIFOFGDCQU-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 386060   
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
Proline-rich AKT1 substrate 1


(Homo sapiens (Human))
BDBM386060
PNG
(4-(4-(1-(4-chloro-3-fluorophenyl)-2-(piperidin-1-y...)
Show SMILES Fc1cc(ccc1Cl)C(CN1CCCCC1)N1CCN(CC1)c1ncnc2NCC(=O)Nc12
Show InChI InChI=1S/C23H29ClFN7O/c24-17-5-4-16(12-18(17)25)19(14-30-6-2-1-3-7-30)31-8-10-32(11-9-31)23-21-22(27-15-28-23)26-13-20(33)29-21/h4-5,12,15,19H,1-3,6-11,13-14H2,(H,29,33)(H,26,27,28)
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 750n/an/an/an/an/an/a



University of Wisconsin at Madison



Assay Description
A TTP Mosquito liquid handling instrument was used to place 125 nl of the appropriate concentration of inhibitor in 100% DMSO (for a dose response cu...


J Med Chem 51: 7243-52 (2008)


BindingDB Entry DOI: 10.7270/Q26M394B
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase beta-1 [T412E]


(Homo sapiens (Human))
BDBM386060
PNG
(4-(4-(1-(4-chloro-3-fluorophenyl)-2-(piperidin-1-y...)
Show SMILES Fc1cc(ccc1Cl)C(CN1CCCCC1)N1CCN(CC1)c1ncnc2NCC(=O)Nc12
Show InChI InChI=1S/C23H29ClFN7O/c24-17-5-4-16(12-18(17)25)19(14-30-6-2-1-3-7-30)31-8-10-32(11-9-31)23-21-22(27-15-28-23)26-13-20(33)29-21/h4-5,12,15,19H,1-3,6-11,13-14H2,(H,29,33)(H,26,27,28)
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+3n/an/an/an/an/an/a



University of Wisconsin at Madison



Assay Description
P70S6K inhibitor compounds were diluted and plated in 96 well plates. A reaction mixture including the following components was then added to the com...


J Med Chem 51: 7243-52 (2008)


BindingDB Entry DOI: 10.7270/Q26M394B
More data for this
Ligand-Target Pair