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Compile Data Set for Download or QSAR

Found 7 hits of ic50 for monomerid = 50311889   
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 Lck


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 14n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused LCK expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 20n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused KDR expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lyn


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 28n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused LYN expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 107n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused SRC expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 238n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused LCK expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Tyrosine-protein kinase HCK


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 904n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of HCK


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50311889
PNG
(3-(1-(6-aminopyrimidin-4-yl)-1H-benzo[d]imidazol-2...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H24F3N9O/c1-17-7-8-19(28(43)38-21-10-20(30(31,32)33)11-22(12-21)41-14-18(2)37-16-41)9-24(17)40-29-39-23-5-3-4-6-25(23)42(29)27-13-26(34)35-15-36-27/h3-16H,1-2H3,(H,38,43)(H,39,40)(H2,34,35,36)
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n/an/a 7.63E+3n/an/an/an/an/an/a



Genomics Institute of the Novartis Research Foundation (GNF)

Curated by ChEMBL


Assay Description
Inhibition of Tel-fused InsR expressed in mouse BAF3 cells


Bioorg Med Chem Lett 19: 6691-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.123
BindingDB Entry DOI: 10.7270/Q2Q52PRR
More data for this
Ligand-Target Pair