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BDBM162032 US9682991, 88

SMILES: CN1CCOc2c1c(NCC1CCN(CC3CC3)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1

InChI Key: InChIKey=JKYVSSSJTRXLHP-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 162032   
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
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM162032
PNG
(US9682991, 88)
Show SMILES CN1CCOc2c1c(NCC1CCN(CC3CC3)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C25H30F3N7O2/c1-33-11-12-36-21-20(33)22(29-14-16-7-9-34(10-8-16)15-17-5-6-17)32-35-23(30-31-24(21)35)18-3-2-4-19(13-18)37-25(26,27)28/h2-4,13,16-17H,5-12,14-15H2,1H3,(H,29,32)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



FUNDACIÓN CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III

US Patent


Assay Description
The biochemical assay to measure PIM-1 activity relies on the ADP Hunter assay kit (DiscoveRx Corp., Cat. #90-0077), that determines the amount of AD...


US Patent US9682991 (2017)


BindingDB Entry DOI: 10.7270/Q2513WCB
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM162032
PNG
(US9682991, 88)
Show SMILES CN1CCOc2c1c(NCC1CCN(CC3CC3)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C25H30F3N7O2/c1-33-11-12-36-21-20(33)22(29-14-16-7-9-34(10-8-16)15-17-5-6-17)32-35-23(30-31-24(21)35)18-3-2-4-19(13-18)37-25(26,27)28/h2-4,13,16-17H,5-12,14-15H2,1H3,(H,29,32)
KEGG

UniProtKB/SwissProt

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



FUNDACIÓN CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III

US Patent


Assay Description
The biochemical assay to measure PIM-3 activity relies on the ADP Hunter assay kit (DiscoveRx Corp., Cat. #90-0077), that determines the amount of AD...


US Patent US9682991 (2017)


BindingDB Entry DOI: 10.7270/Q2513WCB
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))
BDBM162032
PNG
(US9682991, 88)
Show SMILES CN1CCOc2c1c(NCC1CCN(CC3CC3)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C25H30F3N7O2/c1-33-11-12-36-21-20(33)22(29-14-16-7-9-34(10-8-16)15-17-5-6-17)32-35-23(30-31-24(21)35)18-3-2-4-19(13-18)37-25(26,27)28/h2-4,13,16-17H,5-12,14-15H2,1H3,(H,29,32)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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



FUNDACIÓN CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III

US Patent


Assay Description
The biochemical assay to measure PIM-2 activity relies on the ADP Hunter assay kit (DiscoveRx Corp., Cat. #90-0077), that determines the amount of AD...


US Patent US9682991 (2017)


BindingDB Entry DOI: 10.7270/Q2513WCB
More data for this
Ligand-Target Pair