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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase pim-1' and Ligand = 'BDBM377193'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM377193
PNG
(5-Amino-N-{4-[(3S,5R)-3-amino-5-(trifluoromethyl)p...)
Show SMILES N[C@H]1C[C@H](CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
Show InChI InChI=1S/C23H21F5N6O2S/c24-13-2-1-3-14(25)16(13)22-33-17(19(30)37-22)20(35)32-15-7-31-21-12(4-5-36-21)18(15)34-8-10(23(26,27)28)6-11(29)9-34/h1-3,7,10-11H,4-6,8-9,29-30H2,(H,32,35)/t10-,11+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Curacyte Chemistry GmbH



Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


J Med Chem 49: 4116-26 (2006)


BindingDB Entry DOI: 10.7270/Q2FJ2K39
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM377193
PNG
(5-Amino-N-{4-[(3S,5R)-3-amino-5-(trifluoromethyl)p...)
Show SMILES N[C@H]1C[C@H](CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
Show InChI InChI=1S/C23H21F5N6O2S/c24-13-2-1-3-14(25)16(13)22-33-17(19(30)37-22)20(35)32-15-7-31-21-12(4-5-36-21)18(15)34-8-10(23(26,27)28)6-11(29)9-34/h1-3,7,10-11H,4-6,8-9,29-30H2,(H,32,35)/t10-,11+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
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n/an/a<100n/an/an/an/an/an/a


TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2GB2776
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM377193
PNG
(5-Amino-N-{4-[(3S,5R)-3-amino-5-(trifluoromethyl)p...)
Show SMILES N[C@H]1C[C@H](CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
Show InChI InChI=1S/C23H21F5N6O2S/c24-13-2-1-3-14(25)16(13)22-33-17(19(30)37-22)20(35)32-15-7-31-21-12(4-5-36-21)18(15)34-8-10(23(26,27)28)6-11(29)9-34/h1-3,7,10-11H,4-6,8-9,29-30H2,(H,32,35)/t10-,11+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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



Incyte Corporation; Incyte Holdings Corporation

US Patent


Assay Description
Pim-1 and Pim-3 kinase assays—20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μcompound/DMSO in the assa...


US Patent US10828290 (2020)


BindingDB Entry DOI: 10.7270/Q2TB19Z5
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM377193
PNG
(5-Amino-N-{4-[(3S,5R)-3-amino-5-(trifluoromethyl)p...)
Show SMILES N[C@H]1C[C@H](CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
Show InChI InChI=1S/C23H21F5N6O2S/c24-13-2-1-3-14(25)16(13)22-33-17(19(30)37-22)20(35)32-15-7-31-21-12(4-5-36-21)18(15)34-8-10(23(26,27)28)6-11(29)9-34/h1-3,7,10-11H,4-6,8-9,29-30H2,(H,32,35)/t10-,11+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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



Incyte Holdings Corporation; Incyte Corporation

US Patent


Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.84 compound/DMSO in the assay buffer (...


US Patent US10517858 (2019)


BindingDB Entry DOI: 10.7270/Q2XD1422
More data for this
Ligand-Target Pair