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BDBM50021636 CHEMBL3298817

SMILES: FC(F)(F)c1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCC3CCOCC3)n2c1

InChI Key: InChIKey=GUZJUXQQGHIDBV-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 = 50021636   
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))
BDBM50021636
PNG
(CHEMBL3298817)
Show SMILES FC(F)(F)c1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCC3CCOCC3)n2c1
Show InChI InChI=1S/C22H24F3N3O3/c23-22(24,25)17-3-1-2-15(8-17)16-9-19-21(30)27-12-18(28(19)13-16)10-20(29)26-11-14-4-6-31-7-5-14/h1-3,8-9,13-14,18H,4-7,10-12H2,(H,26,29)(H,27,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 3.13E+3n/an/an/an/an/an/a



Nerviano Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of human PIM2 using ARK-RERTYSFGHHA as substrate incubated for 60 mins prior to substrate addition by topcount scintillation counting anal...


Bioorg Med Chem 21: 7364-80 (2013)


Article DOI: 10.1016/j.bmc.2013.09.054
BindingDB Entry DOI: 10.7270/Q23F4R7S
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM50021636
PNG
(CHEMBL3298817)
Show SMILES FC(F)(F)c1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCC3CCOCC3)n2c1
Show InChI InChI=1S/C22H24F3N3O3/c23-22(24,25)17-3-1-2-15(8-17)16-9-19-21(30)27-12-18(28(19)13-16)10-20(29)26-11-14-4-6-31-7-5-14/h1-3,8-9,13-14,18H,4-7,10-12H2,(H,26,29)(H,27,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 838n/an/an/an/an/an/a



Nerviano Medical Sciences

Curated by ChEMBL


Assay Description
Inhibition of human PIM1 using ARK-RERTYSFGHHA as substrate incubated for 60 mins prior to substrate addition by topcount scintillation counting anal...


Bioorg Med Chem 21: 7364-80 (2013)


Article DOI: 10.1016/j.bmc.2013.09.054
BindingDB Entry DOI: 10.7270/Q23F4R7S
More data for this
Ligand-Target Pair