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Compile Data Set for Download or QSAR

Found 154 hits Enz. Inhib. hit(s) with all data for entry = 1884   
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
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346014
PNG
(US10202370, Example 003 | {6-Methyl-2-[4-(4- methy...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2nc3cc(C)c(Nc4nc(cs4)-c4cccnc4)cc3[nH]2)CC1
Show InChI InChI=1S/C28H29N7S/c1-19-14-24-25(15-23(19)32-28-33-26(18-36-28)22-4-3-9-29-16-22)31-27(30-24)21-7-5-20(6-8-21)17-35-12-10-34(2)11-13-35/h3-9,14-16,18H,10-13,17H2,1-2H3,(H,30,31)(H,32,33)
PDB

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AB SCIENCE

US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346015
PNG
(US10202370, Example 005 | [6-Methyl-2-(3- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C23H16F3N5S/c1-13-8-18-19(29-21(28-18)14-4-2-6-16(9-14)23(24,25)26)10-17(13)30-22-31-20(12-32-22)15-5-3-7-27-11-15/h2-12H,1H3,(H,28,29)(H,30,31)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346016
PNG
(US10202370, Example 008 | [6-Methyl-2-(3- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nccc(n1)-c1cccnc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C24H17F3N6/c1-14-10-20-21(31-22(30-20)15-4-2-6-17(11-15)24(25,26)27)12-19(14)33-23-29-9-7-18(32-23)16-5-3-8-28-13-16/h2-13H,1H3,(H,30,31)(H,29,32,33)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346017
PNG
(3-[5-Methyl-6-(4- pyridin-3-yl-thiazol- 2-ylamino)...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(c1)C#N
Show InChI InChI=1S/C23H16N6S/c1-14-8-19-20(27-22(26-19)16-5-2-4-15(9-16)11-24)10-18(14)28-23-29-21(13-30-23)17-6-3-7-25-12-17/h2-10,12-13H,1H3,(H,26,27)(H,28,29)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346018
PNG
((6-Methyl-2-m-tolyl- 3H-benzoimidazol-5- yl)-(4-py...)
Show SMILES Cc1cccc(c1)-c1nc2cc(C)c(Nc3nc(cs3)-c3cccnc3)cc2[nH]1
Show InChI InChI=1S/C23H19N5S/c1-14-5-3-6-16(9-14)22-25-19-10-15(2)18(11-20(19)26-22)27-23-28-21(13-29-23)17-7-4-8-24-12-17/h3-13H,1-2H3,(H,25,26)(H,27,28)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346019
PNG
(US10202370, Example 020 | [6-Methyl-2-(3- morpholi...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cc(CN2CCOCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H25F3N6OS/c1-17-9-23-24(13-22(17)35-27-36-25(16-39-27)19-3-2-4-32-14-19)34-26(33-23)20-10-18(11-21(12-20)28(29,30)31)15-37-5-7-38-8-6-37/h2-4,9-14,16H,5-8,15H2,1H3,(H,33,34)(H,35,36)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346020
PNG
(US10202370, Example 024 | [6-Methyl-2-(3- piperidi...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cc(CN2CCCCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C29H27F3N6S/c1-18-10-24-25(14-23(18)36-28-37-26(17-39-28)20-6-5-7-33-15-20)35-27(34-24)21-11-19(12-22(13-21)29(30,31)32)16-38-8-3-2-4-9-38/h5-7,10-15,17H,2-4,8-9,16H2,1H3,(H,34,35)(H,36,37)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346021
PNG
(US10202370, Example 025 | [2-(3-Difluoromethyl- ph...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C23H17F2N5S/c1-13-8-18-19(28-22(27-18)15-5-2-4-14(9-15)21(24)25)10-17(13)29-23-30-20(12-31-23)16-6-3-7-26-11-16/h2-12,21H,1H3,(H,27,28)(H,29,30)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346022
PNG
(US10202370, Example 026 | [6-Methyl-2-(3- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C23H16F3N5OS/c1-13-8-18-19(29-21(28-18)14-4-2-6-16(9-14)32-23(24,25)26)10-17(13)30-22-31-20(12-33-22)15-5-3-7-27-11-15/h2-12H,1H3,(H,28,29)(H,30,31)
PDB

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AB SCIENCE

US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346023
PNG
(US10202370, Example 028 | [6-Methyl-2-(3- morpholi...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nccc(n1)-c1cccnc1)-c1cc(CN2CCOCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C29H26F3N7O/c1-18-11-25-26(15-24(18)38-28-34-6-4-23(37-28)20-3-2-5-33-16-20)36-27(35-25)21-12-19(13-22(14-21)29(30,31)32)17-39-7-9-40-10-8-39/h2-6,11-16H,7-10,17H2,1H3,(H,35,36)(H,34,37,38)
PDB

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AB SCIENCE

US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346024
PNG
(US10202370, Example 029 | [6-Methyl-2-(3- pyrrolid...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nccc(n1)-c1cccnc1)-c1cc(CN2CCCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C29H26F3N7/c1-18-11-25-26(15-24(18)38-28-34-8-6-23(37-28)20-5-4-7-33-16-20)36-27(35-25)21-12-19(17-39-9-2-3-10-39)13-22(14-21)29(30,31)32/h4-8,11-16H,2-3,9-10,17H2,1H3,(H,35,36)(H,34,37,38)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346025
PNG
(US10202370, Example 030 | [2-(3-Difluoromethyl- ph...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nccc(n1)-c1cccnc1)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C24H18F2N6/c1-14-10-20-21(30-23(29-20)16-5-2-4-15(11-16)22(25)26)12-19(14)32-24-28-9-7-18(31-24)17-6-3-8-27-13-17/h2-13,22H,1H3,(H,29,30)(H,28,31,32)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346026
PNG
(US10202370, Example 031 | [2-(3-Chloro-phenyl)- 6-...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nccc(n1)-c1cccnc1)-c1cccc(Cl)c1
Show InChI InChI=1S/C23H17ClN6/c1-14-10-20-21(28-22(27-20)15-4-2-6-17(24)11-15)12-19(14)30-23-26-9-7-18(29-23)16-5-3-8-25-13-16/h2-13H,1H3,(H,27,28)(H,26,29,30)
PDB

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AB SCIENCE

US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346027
PNG
(US10202370, Example 032 | [2-(3-Chloro-phenyl)- 6-...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(Cl)c1
Show InChI InChI=1S/C22H16ClN5S/c1-13-8-18-19(26-21(25-18)14-4-2-6-16(23)9-14)10-17(13)27-22-28-20(12-29-22)15-5-3-7-24-11-15/h2-12H,1H3,(H,25,26)(H,27,28)
PDB

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AB SCIENCE

US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346028
PNG
(US10202370, Example 033 | [6-Methyl-2-(3- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccncc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C23H16F3N5S/c1-13-9-18-19(29-21(28-18)15-3-2-4-16(10-15)23(24,25)26)11-17(13)30-22-31-20(12-32-22)14-5-7-27-8-6-14/h2-12H,1H3,(H,28,29)(H,30,31)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346029
PNG
((6-Methyl-2-m-tolyl- 3H-benzoimidazol-5- yl)-(4-py...)
Show SMILES Cc1cccc(c1)-c1nc2cc(C)c(Nc3nc(cs3)-c3ccncc3)cc2[nH]1
Show InChI InChI=1S/C23H19N5S/c1-14-4-3-5-17(10-14)22-25-19-11-15(2)18(12-20(19)26-22)27-23-28-21(13-29-23)16-6-8-24-9-7-16/h3-13H,1-2H3,(H,25,26)(H,27,28)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346030
PNG
(US10202370, Example 035 | [6-Methyl-2-(3- piperidi...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nccc(n1)-c1cccnc1)-c1cc(CN2CCCCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H28F3N7/c1-19-12-26-27(16-25(19)39-29-35-9-7-24(38-29)21-6-5-8-34-17-21)37-28(36-26)22-13-20(14-23(15-22)30(31,32)33)18-40-10-3-2-4-11-40/h5-9,12-17H,2-4,10-11,18H2,1H3,(H,36,37)(H,35,38,39)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346031
PNG
(US10202370, Example 041 | [6-Methyl-2-(4- methyl-3...)
Show SMILES Cc1ccc(cc1C(F)(F)F)-c1nc2cc(C)c(Nc3nccc(n3)-c3cccnc3)cc2[nH]1
Show InChI InChI=1S/C25H19F3N6/c1-14-5-6-16(11-18(14)25(26,27)28)23-31-21-10-15(2)20(12-22(21)32-23)34-24-30-9-7-19(33-24)17-4-3-8-29-13-17/h3-13H,1-2H3,(H,31,32)(H,30,33,34)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346032
PNG
(US10202370, Example 045 | [2-(3-Difluoromethyl- ph...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccncc1)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C23H17F2N5S/c1-13-9-18-19(28-22(27-18)16-4-2-3-15(10-16)21(24)25)11-17(13)29-23-30-20(12-31-23)14-5-7-26-8-6-14/h2-12,21H,1H3,(H,27,28)(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346033
PNG
(US10202370, Example 047 | [6-Methyl-2-(3- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccncc1)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C23H16F3N5OS/c1-13-9-18-19(29-21(28-18)15-3-2-4-16(10-15)32-23(24,25)26)11-17(13)30-22-31-20(12-33-22)14-5-7-27-8-6-14/h2-12H,1H3,(H,28,29)(H,30,31)
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AB SCIENCE

US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346034
PNG
(US10202370, Example 049 | [6-Methyl-2-(5- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cncc(c1)C(F)(F)F
Show InChI InChI=1S/C22H15F3N6S/c1-12-5-17-18(29-20(28-17)14-6-15(10-27-9-14)22(23,24)25)7-16(12)30-21-31-19(11-32-21)13-3-2-4-26-8-13/h2-11H,1H3,(H,28,29)(H,30,31)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346035
PNG
(US10202370, Example 050 | [6-Methyl-2-(4- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccncc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H16F3N5S/c1-13-10-18-19(29-21(28-18)15-2-4-16(5-3-15)23(24,25)26)11-17(13)30-22-31-20(12-32-22)14-6-8-27-9-7-14/h2-12H,1H3,(H,28,29)(H,30,31)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346036
PNG
(US10202370, Example 056 | [6-Methyl-2-(4- methyl-3...)
Show SMILES Cc1ccc(cc1C(F)(F)F)-c1nc2cc(C)c(Nc3nc(cs3)-c3cccnc3)cc2[nH]1
Show InChI InChI=1S/C24H18F3N5S/c1-13-5-6-15(9-17(13)24(25,26)27)22-29-19-8-14(2)18(10-20(19)30-22)31-23-32-21(12-33-23)16-4-3-7-28-11-16/h3-12H,1-2H3,(H,29,30)(H,31,32)
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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346037
PNG
(US10202370, Example 057 | [6-Methyl-2-(4- pyrazol-...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1ccc(cc1)-n1cccn1
Show InChI InChI=1S/C25H19N7S/c1-16-12-21-22(13-20(16)30-25-31-23(15-33-25)18-4-2-9-26-14-18)29-24(28-21)17-5-7-19(8-6-17)32-11-3-10-27-32/h2-15H,1H3,(H,28,29)(H,30,31)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346038
PNG
(US10202370, Example 058 | [2-(3-Fluoro-5- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cccnc1)-c1cc(F)cc(c1)C(F)(F)F
Show InChI InChI=1S/C23H15F4N5S/c1-12-5-18-19(30-21(29-18)14-6-15(23(25,26)27)8-16(24)7-14)9-17(12)31-22-32-20(11-33-22)13-3-2-4-28-10-13/h2-11H,1H3,(H,29,30)(H,31,32)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346039
PNG
(US10202370, Example 061 | [2-(3-Difluoromethyl- ph...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cncnc1)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C22H16F2N6S/c1-12-5-17-18(28-21(27-17)14-4-2-3-13(6-14)20(23)24)7-16(12)29-22-30-19(10-31-22)15-8-25-11-26-9-15/h2-11,20H,1H3,(H,27,28)(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346040
PNG
(US10202370, Example 062 | [6-Methyl-2-(3- trifluor...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1cncnc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C22H15F3N6S/c1-12-5-17-18(29-20(28-17)13-3-2-4-15(6-13)22(23,24)25)7-16(12)30-21-31-19(10-32-21)14-8-26-11-27-9-14/h2-11H,1H3,(H,28,29)(H,30,31)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346041
PNG
(4-{2-[2-(3- Difluoromethyl- phenyl)-6-methyl- 3H-b...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccc(cc1)C#N)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C25H17F2N5S/c1-14-9-20-21(30-24(29-20)18-4-2-3-17(10-18)23(26)27)11-19(14)31-25-32-22(13-33-25)16-7-5-15(12-28)6-8-16/h2-11,13,23H,1H3,(H,29,30)(H,31,32)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346043
PNG
(4-{2-[6-Methyl-2-(3- trifluoromethyl- phenyl)-3H- ...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccc(cc1)C#N)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C25H16F3N5S/c1-14-9-20-21(31-23(30-20)17-3-2-4-18(10-17)25(26,27)28)11-19(14)32-24-33-22(13-34-24)16-7-5-15(12-29)6-8-16/h2-11,13H,1H3,(H,30,31)(H,32,33)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346044
PNG
(4-{2-[2-(3- Difluoromethyl- phenyl)-6-methyl- 3H-b...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccc(cc1)C(N)=O)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C25H19F2N5OS/c1-13-9-19-20(30-24(29-19)17-4-2-3-16(10-17)22(26)27)11-18(13)31-25-32-21(12-34-25)14-5-7-15(8-6-14)23(28)33/h2-12,22H,1H3,(H2,28,33)(H,29,30)(H,31,32)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346045
PNG
(4-{2-[6-Methyl-2-(4- trifluoromethyl- phenyl)-3H- ...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccc(cc1)C(N)=O)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H18F3N5OS/c1-13-10-19-20(31-23(30-19)16-6-8-17(9-7-16)25(26,27)28)11-18(13)32-24-33-21(12-35-24)14-2-4-15(5-3-14)22(29)34/h2-12H,1H3,(H2,29,34)(H,30,31)(H,32,33)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346046
PNG
(4-{2-[6-Methyl-2-(3- trifluoromethoxy- phenyl)-3H-...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccc(cc1)C#N)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C25H16F3N5OS/c1-14-9-20-21(31-23(30-20)17-3-2-4-18(10-17)34-25(26,27)28)11-19(14)32-24-33-22(13-35-24)16-7-5-15(12-29)6-8-16/h2-11,13H,1H3,(H,30,31)(H,32,33)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346047
PNG
(4-[2-(6-Methyl-2-m- tolyl-3H- benzoimidazol-5- yla...)
Show SMILES Cc1cccc(c1)-c1nc2cc(C)c(Nc3nc(cs3)-c3ccc(cc3)C#N)cc2[nH]1
Show InChI InChI=1S/C25H19N5S/c1-15-4-3-5-19(10-15)24-27-21-11-16(2)20(12-22(21)28-24)29-25-30-23(14-31-25)18-8-6-17(13-26)7-9-18/h3-12,14H,1-2H3,(H,27,28)(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346046
PNG
(4-{2-[6-Methyl-2-(3- trifluoromethoxy- phenyl)-3H-...)
Show SMILES Cc1cc2nc([nH]c2cc1Nc1nc(cs1)-c1ccc(cc1)C#N)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C25H16F3N5OS/c1-14-9-20-21(31-23(30-20)17-3-2-4-18(10-17)34-25(26,27)28)11-19(14)32-24-33-22(13-35-24)16-7-5-15(12-29)6-8-16/h2-11,13H,1H3,(H,30,31)(H,32,33)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346049
PNG
(US10202370, Example 078 | [6-Methyl-2-(5- methyl-t...)
Show SMILES Cc1ccc(s1)-c1nc2cc(C)c(Nc3nc(cs3)-c3cccnc3)cc2[nH]1
Show InChI InChI=1S/C21H17N5S2/c1-12-8-16-17(24-20(23-16)19-6-5-13(2)28-19)9-15(12)25-21-26-18(11-27-21)14-4-3-7-22-10-14/h3-11H,1-2H3,(H,23,24)(H,25,26)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346050
PNG
(US10202370, Example 079 | [6-Methyl-2-(5- methyl-t...)
Show SMILES Cc1ccc(s1)-c1nc2cc(Nc3nc(cs3)-c3ccncc3)c(C)cc2[nH]1
Show InChI InChI=1S/C21H17N5S2/c1-12-9-16-17(24-20(23-16)19-4-3-13(2)28-19)10-15(12)25-21-26-18(11-27-21)14-5-7-22-8-6-14/h3-11H,1-2H3,(H,23,24)(H,25,26)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346051
PNG
(US10202370, Example 081 | [2-(3-Difluoromethyl- ph...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1ccncc1)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C24H19F2N5S/c1-14-10-21-19(28-23(31(21)2)17-5-3-4-16(11-17)22(25)26)12-18(14)29-24-30-20(13-32-24)15-6-8-27-9-7-15/h3-13,22H,1-2H3,(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346052
PNG
(US10202370, Example 082 | [1,6-Dimethyl-2-(3- trif...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1ccncc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C24H18F3N5S/c1-14-10-21-19(29-22(32(21)2)16-4-3-5-17(11-16)24(25,26)27)12-18(14)30-23-31-20(13-33-23)15-6-8-28-9-7-15/h3-13H,1-2H3,(H,30,31)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346053
PNG
(US10202370, Example 083 | [1,6-Dimethyl-2-(3- trif...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1ccncc1)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C24H18F3N5OS/c1-14-10-21-19(12-18(14)30-23-31-20(13-34-23)15-6-8-28-9-7-15)29-22(32(21)2)16-4-3-5-17(11-16)33-24(25,26)27/h3-13H,1-2H3,(H,30,31)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346054
PNG
(US10202370, Example 084 | [2-(3-Difluoromethyl- ph...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C24H19F2N5S/c1-14-9-21-19(28-23(31(21)2)16-6-3-5-15(10-16)22(25)26)11-18(14)29-24-30-20(13-32-24)17-7-4-8-27-12-17/h3-13,22H,1-2H3,(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346055
PNG
(US10202370, Example 085 | [1,6-Dimethyl-2-(3- trif...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C24H18F3N5S/c1-14-9-21-19(29-22(32(21)2)15-5-3-7-17(10-15)24(25,26)27)11-18(14)30-23-31-20(13-33-23)16-6-4-8-28-12-16/h3-13H,1-2H3,(H,30,31)
PDB

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Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346056
PNG
(US10202370, Example 086 | [1,6-Dimethyl-2-(3- trif...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1cccnc1)-c1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C24H18F3N5OS/c1-14-9-21-19(11-18(14)30-23-31-20(13-34-23)16-6-4-8-28-12-16)29-22(32(21)2)15-5-3-7-17(10-15)33-24(25,26)27/h3-13H,1-2H3,(H,30,31)
PDB

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Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346057
PNG
(US10202370, Example 087 | [2-(3-Difluoromethyl- ph...)
Show SMILES FC(F)c1cccc(c1)-c1nc2cc(Nc3nc(cs3)-c3cccnc3)ccc2[nH]1
Show InChI InChI=1S/C22H15F2N5S/c23-20(24)13-3-1-4-14(9-13)21-27-17-7-6-16(10-18(17)28-21)26-22-29-19(12-30-22)15-5-2-8-25-11-15/h1-12,20H,(H,26,29)(H,27,28)
PDB

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Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346058
PNG
((4-Pyridin-3-yl- thiazol-2-yl)-[2-(3- trifluoromet...)
Show SMILES FC(F)(F)Oc1cccc(c1)-c1nc2cc(Nc3nc(cs3)-c3cccnc3)ccc2[nH]1
Show InChI InChI=1S/C22H14F3N5OS/c23-22(24,25)31-16-5-1-3-13(9-16)20-28-17-7-6-15(10-18(17)29-20)27-21-30-19(12-32-21)14-4-2-8-26-11-14/h1-12H,(H,27,30)(H,28,29)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346059
PNG
(US10202370, Example 093 | [2-(4-Difluoromethyl- ph...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1cccnc1)-c1ccc(cc1)C(F)F
Show InChI InChI=1S/C24H19F2N5S/c1-14-10-21-19(28-23(31(21)2)16-7-5-15(6-8-16)22(25)26)11-18(14)29-24-30-20(13-32-24)17-4-3-9-27-12-17/h3-13,22H,1-2H3,(H,29,30)
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Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346060
PNG
(US10202370, Example 094 | [2-(4-Difluoromethyl- ph...)
Show SMILES Cc1cc2n(C)c(nc2cc1Nc1nc(cs1)-c1ccncc1)-c1ccc(cc1)C(F)F
Show InChI InChI=1S/C24H19F2N5S/c1-14-11-21-19(28-23(31(21)2)17-5-3-16(4-6-17)22(25)26)12-18(14)29-24-30-20(13-32-24)15-7-9-27-10-8-15/h3-13,22H,1-2H3,(H,29,30)
PDB

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Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346061
PNG
(US10202370, Example 097 | [2-(4-Difluoromethyl- ph...)
Show SMILES Cc1cc2[nH]c(nc2cc1Nc1nc(cs1)-c1cccnc1)-c1ccc(cc1)C(F)F
Show InChI InChI=1S/C23H17F2N5S/c1-13-9-18-19(28-22(27-18)15-6-4-14(5-7-15)21(24)25)10-17(13)29-23-30-20(12-31-23)16-3-2-8-26-11-16/h2-12,21H,1H3,(H,27,28)(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346062
PNG
(US10202370, Example 100 | [2-(3-Difluoromethyl- ph...)
Show SMILES CC(C)n1c(nc2cc(Nc3nc(cs3)-c3ccncc3)c(C)cc12)-c1cccc(c1)C(F)F
Show InChI InChI=1S/C26H23F2N5S/c1-15(2)33-23-11-16(3)20(31-26-32-22(14-34-26)17-7-9-29-10-8-17)13-21(23)30-25(33)19-6-4-5-18(12-19)24(27)28/h4-15,24H,1-3H3,(H,31,32)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346063
PNG
(US10202370, Example 101 | [1-Isopropyl-6- methyl-2...)
Show SMILES CC(C)n1c(nc2cc(Nc3nc(cs3)-c3ccncc3)c(C)cc12)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C26H22F3N5S/c1-15(2)34-23-11-16(3)20(32-25-33-22(14-35-25)17-7-9-30-10-8-17)13-21(23)31-24(34)18-5-4-6-19(12-18)26(27,28)29/h4-15H,1-3H3,(H,32,33)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM346064
PNG
((1-Isopropyl-6- methyl-2-m-tolyl-1H- benzoimidazol...)
Show SMILES CC(C)n1c(nc2cc(Nc3nc(cs3)-c3ccncc3)c(C)cc12)-c1cccc(C)c1
Show InChI InChI=1S/C26H25N5S/c1-16(2)31-24-13-18(4)21(14-22(24)28-25(31)20-7-5-6-17(3)12-20)29-26-30-23(15-32-26)19-8-10-27-11-9-19/h5-16H,1-4H3,(H,29,30)
PDB

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US Patent


Assay Description
Colorimetric cell proliferation and viability assay (reagent CellTiter-Blue purchased from Promega cat N°G8081) was performed on BaF3 Kit WT cell lin...


US Patent US10202370 (2019)


BindingDB Entry DOI: 10.7270/Q2Q52RRK
More data for this
Ligand-Target Pair
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