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BDBM352153 4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-N-{[6-(1-benzothien-5-yl)-5-fluoropyridin-2-yl]methyl}pyridin-3-amine::US9802918, Example 85

SMILES: C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc2sccc2c1

InChI Key: InChIKey=QZOISWBCYKUCLX-FFXKXJTCNA-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 = 352153   
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))
BDBM352153
PNG
(4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-N-{[6-(...)
Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc2sccc2c1
Show InChI InChI=1/C25H26FN5S/c1-16-10-19(27)15-31(14-16)23-6-8-28-13-22(23)29-12-20-3-4-21(26)25(30-20)18-2-5-24-17(11-18)7-9-32-24/h2-9,11,13,16,19,29H,10,12,14-15,27H2,1H3/t16-,19+/s2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<10n/an/an/an/an/an/a



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 0.8 μL compound/DMSO in the assay b...


US Patent US9802918 (2017)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q2F47R9T
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM352153
PNG
(4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-N-{[6-(...)
Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc2sccc2c1
Show InChI InChI=1/C25H26FN5S/c1-16-10-19(27)15-31(14-16)23-6-8-28-13-22(23)29-12-20-3-4-21(26)25(30-20)18-2-5-24-17(11-18)7-9-32-24/h2-9,11,13,16,19,29H,10,12,14-15,27H2,1H3/t16-,19+/s2
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<10n/an/an/an/an/an/a



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 0.8 μL compound/DMSO in the assay b...


US Patent US9802918 (2017)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q2F47R9T
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))
BDBM352153
PNG
(4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-N-{[6-(...)
Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc2sccc2c1
Show InChI InChI=1/C25H26FN5S/c1-16-10-19(27)15-31(14-16)23-6-8-28-13-22(23)29-12-20-3-4-21(26)25(30-20)18-2-5-24-17(11-18)7-9-32-24/h2-9,11,13,16,19,29H,10,12,14-15,27H2,1H3/t16-,19+/s2
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 550n/an/an/an/an/an/a



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 0.8 μL compound/DMSO in the assay b...


US Patent US9802918 (2017)


Article DOI: 10.1021/jm031057+
BindingDB Entry DOI: 10.7270/Q2F47R9T
More data for this
Ligand-Target Pair