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BDBM352130 (3R,4R,5S)-3-Amino-1-{3-[({6-[2,6-difluoro-4-(4-methoxytetrahydro-2H-pyran-4-yl)phenyl]-5-fluoropyridin-2-yl}methyl)amino]pyridin-4-yl}-5-methylpiperidin-4-ol::US9802918, Example 59

SMILES: COC1(CCOCC1)c1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F

InChI Key: InChIKey=XMEFQTORGMKXJZ-IIBVFMKONA-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 = 352130   
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))
BDBM352130
PNG
((3R,4R,5S)-3-Amino-1-{3-[({6-[2,6-difluoro-4-(4-me...)
Show SMILES COC1(CCOCC1)c1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F
Show InChI InChI=1/C29H34F3N5O3/c1-17-15-37(16-23(33)28(17)38)25-5-8-34-14-24(25)35-13-19-3-4-20(30)27(36-19)26-21(31)11-18(12-22(26)32)29(39-2)6-9-40-10-7-29/h3-5,8,11-12,14,17,23,28,35,38H,6-7,9-10,13,15-16,33H2,1-2H3/t17-,23+,28+/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))
BDBM352130
PNG
((3R,4R,5S)-3-Amino-1-{3-[({6-[2,6-difluoro-4-(4-me...)
Show SMILES COC1(CCOCC1)c1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F
Show InChI InChI=1/C29H34F3N5O3/c1-17-15-37(16-23(33)28(17)38)25-5-8-34-14-24(25)35-13-19-3-4-20(30)27(36-19)26-21(31)11-18(12-22(26)32)29(39-2)6-9-40-10-7-29/h3-5,8,11-12,14,17,23,28,35,38H,6-7,9-10,13,15-16,33H2,1-2H3/t17-,23+,28+/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))
BDBM352130
PNG
((3R,4R,5S)-3-Amino-1-{3-[({6-[2,6-difluoro-4-(4-me...)
Show SMILES COC1(CCOCC1)c1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F
Show InChI InChI=1/C29H34F3N5O3/c1-17-15-37(16-23(33)28(17)38)25-5-8-34-14-24(25)35-13-19-3-4-20(30)27(36-19)26-21(31)11-18(12-22(26)32)29(39-2)6-9-40-10-7-29/h3-5,8,11-12,14,17,23,28,35,38H,6-7,9-10,13,15-16,33H2,1-2H3/t17-,23+,28+/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