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BDBM161990 US9682991, 39

SMILES: CC1COc2c(N1C)c(NCC1CCN(C)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1

InChI Key: InChIKey=IOBGPTAILQUDSL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 161990   
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-2


(Homo sapiens (Human))
BDBM161990
PNG
(US9682991, 39)
Show SMILES CC1COc2c(N1C)c(NCC1CCN(C)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C23H28F3N7O2/c1-14-13-34-19-18(32(14)3)20(27-12-15-7-9-31(2)10-8-15)30-33-21(28-29-22(19)33)16-5-4-6-17(11-16)35-23(24,25)26/h4-6,11,14-15H,7-10,12-13H2,1-3H3,(H,27,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/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
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM161990
PNG
(US9682991, 39)
Show SMILES CC1COc2c(N1C)c(NCC1CCN(C)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C23H28F3N7O2/c1-14-13-34-19-18(32(14)3)20(27-12-15-7-9-31(2)10-8-15)30-33-21(28-29-22(19)33)16-5-4-6-17(11-16)35-23(24,25)26/h4-6,11,14-15H,7-10,12-13H2,1-3H3,(H,27,30)
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