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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase Mer' and Ligand = 'BDBM396972'   
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
Tyrosine-protein kinase Mer


(Homo sapiens (Human))
BDBM396972
PNG
(US10442810, Example 34 | US10844069, Example 34 | ...)
Show SMILES Nc1ncnn2c(cc(-c3ccc(NC(=O)c4cccn(-c5ccccc5)c4=O)cc3F)c12)C1CCNCC1
Show InChI InChI=1S/C29H26FN7O2/c30-24-15-19(35-28(38)22-7-4-14-36(29(22)39)20-5-2-1-3-6-20)8-9-21(24)23-16-25(18-10-12-32-13-11-18)37-26(23)27(31)33-17-34-37/h1-9,14-18,32H,10-13H2,(H,35,38)(H2,31,33,34)
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n/an/a<5n/an/an/an/an/an/a



Pfizer



Assay Description
Tyro3, and Mer:The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM MgCl2, 1 mM EGTA, 0.01% NP-40 and 2 mM DTT. 0.1 ul test compounds dissolve...


J Med Chem 52: 3576-85 (2009)


BindingDB Entry DOI: 10.7270/Q2FB5593
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Mer


(Homo sapiens (Human))
BDBM396972
PNG
(US10442810, Example 34 | US10844069, Example 34 | ...)
Show SMILES Nc1ncnn2c(cc(-c3ccc(NC(=O)c4cccn(-c5ccccc5)c4=O)cc3F)c12)C1CCNCC1
Show InChI InChI=1S/C29H26FN7O2/c30-24-15-19(35-28(38)22-7-4-14-36(29(22)39)20-5-2-1-3-6-20)8-9-21(24)23-16-25(18-10-12-32-13-11-18)37-26(23)27(31)33-17-34-37/h1-9,14-18,32H,10-13H2,(H,35,38)(H2,31,33,34)
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n/an/a<5n/an/an/an/an/an/a



Incyte Corporation

US Patent


Assay Description
The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM MgCl2, 1 mM EGTA, 0.01% NP-40 and 2 mM DTT. 0.1 ul test compounds dissolved in DMSO were ...


US Patent US10442810 (2019)


BindingDB Entry DOI: 10.7270/Q2NG4T17
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Mer


(Homo sapiens (Human))
BDBM396972
PNG
(US10442810, Example 34 | US10844069, Example 34 | ...)
Show SMILES Nc1ncnn2c(cc(-c3ccc(NC(=O)c4cccn(-c5ccccc5)c4=O)cc3F)c12)C1CCNCC1
Show InChI InChI=1S/C29H26FN7O2/c30-24-15-19(35-28(38)22-7-4-14-36(29(22)39)20-5-2-1-3-6-20)8-9-21(24)23-16-25(18-10-12-32-13-11-18)37-26(23)27(31)33-17-34-37/h1-9,14-18,32H,10-13H2,(H,35,38)(H2,31,33,34)
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n/an/a<5n/an/an/an/an/an/a



Incyte Corporation

US Patent


Assay Description
The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM MgCl2, 1 mM EGTA, 0.01% NP-40 and 2 mM DTT. 0.1 ul test compounds dissolved in DMSO were ...


US Patent US10844069 (2020)


BindingDB Entry DOI: 10.7270/Q2CZ3B73
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Mer


(Homo sapiens (Human))
BDBM396972
PNG
(US10442810, Example 34 | US10844069, Example 34 | ...)
Show SMILES Nc1ncnn2c(cc(-c3ccc(NC(=O)c4cccn(-c5ccccc5)c4=O)cc3F)c12)C1CCNCC1
Show InChI InChI=1S/C29H26FN7O2/c30-24-15-19(35-28(38)22-7-4-14-36(29(22)39)20-5-2-1-3-6-20)8-9-21(24)23-16-25(18-10-12-32-13-11-18)37-26(23)27(31)33-17-34-37/h1-9,14-18,32H,10-13H2,(H,35,38)(H2,31,33,34)
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n/an/a>100n/an/an/an/an/an/a


TBA

Assay Description
The kinase assay buffer contained 50 mM HEPES, pH7.5, 10 mM MgCl2, 1 mM EGTA, 0.01% NP-40 and 2 mM DTT. 0.1 ul test compounds dissolved in DMSO were ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2MW2N2P
More data for this
Ligand-Target Pair