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Compile Data Set for Download or QSAR

Found 609 hits Enz. Inhib. hit(s) with all data for entry = 50030004   
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
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM100706
PNG
(US8507676, 55)
Show SMILES C\C(=N/OCCF)c1ccc2nnc(Cc3c(F)cc4ncccc4c3F)n2n1
Show InChI InChI=1S/C19H15F3N6O/c1-11(27-29-8-6-20)15-4-5-17-24-25-18(28(17)26-15)9-13-14(21)10-16-12(19(13)22)3-2-7-23-16/h2-5,7,10H,6,8-9H2,1H3/b27-11+
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n/an/a 3.80n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8507676 (2013)


BindingDB Entry DOI: 10.7270/Q2MS3RC9
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM100690
PNG
(US8507676, 37B)
Show SMILES C\C(=N/OCCNC(N)=O)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1
Show InChI InChI=1S/C19H19N9O2/c1-12(26-30-8-7-22-19(20)29)16-10-23-17-18(24-16)28(27-25-17)11-13-4-5-15-14(9-13)3-2-6-21-15/h2-6,9-10H,7-8,11H2,1H3,(H3,20,22,29)/b26-12+
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n/an/a 3.90n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8507676 (2013)


BindingDB Entry DOI: 10.7270/Q2MS3RC9
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439101
PNG
(3-(2,2-dimethyl-1,2,3,4-tetrahydro-1,7-naphthyridi...)
Show SMILES Cc1cc2n(cc(-c3cncc4NC(C)(C)CCc34)c2cc1C#N)[C@H]1CC[C@H](O)CC1 |r,wU:24.27,wD:27.31,(-6.1,.69,;-4.64,1.16,;-3.49,.13,;-2.03,.61,;-.69,-.16,;.45,.87,;-.17,2.28,;.6,3.61,;-.17,4.94,;.6,6.28,;2.14,6.28,;2.91,4.94,;4.45,4.94,;5.22,3.61,;6.55,4.38,;6.55,2.84,;4.45,2.28,;2.91,2.28,;2.14,3.61,;-1.71,2.12,;-2.85,3.15,;-4.32,2.67,;-5.46,3.7,;-6.55,4.79,;-.53,-1.69,;.88,-2.3,;1.07,-3.82,;-.16,-4.75,;.02,-6.28,;-1.58,-4.14,;-1.76,-2.62,)|
Show InChI InChI=1S/C26H30N4O/c1-16-10-25-21(11-17(16)12-27)23(15-30(25)18-4-6-19(31)7-5-18)22-13-28-14-24-20(22)8-9-26(2,3)29-24/h10-11,13-15,18-19,29,31H,4-9H2,1-3H3/t18-,19-
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99246
PNG
(US8497368, 38)
Show SMILES CC(=Nn1cc(O)[nH]c1=O)c1ccc2nnc(Cc3ccc4ncccc4c3)n2n1 |w:2.2|
Show InChI InChI=1S/C20H16N8O2/c1-12(25-27-11-19(29)22-20(27)30)15-6-7-17-23-24-18(28(17)26-15)10-13-4-5-16-14(9-13)3-2-8-21-16/h2-9,11,29H,10H2,1H3,(H,22,30)/b25-12+
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99250
PNG
(US8497368, 42)
Show SMILES CN(N=C(C)c1ccc2nnc(Cc3c(F)cc4ncccc4c3F)n2n1)C(N)=O |w:2.1|
Show InChI InChI=1S/C19H16F2N8O/c1-10(26-28(2)19(22)30)14-5-6-16-24-25-17(29(16)27-14)8-12-13(20)9-15-11(18(12)21)4-3-7-23-15/h3-7,9H,8H2,1-2H3,(H2,22,30)
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99253
PNG
(US8497368, 45)
Show SMILES CC(=NNC(N)=O)c1ccc2nnc(Cc3cc4cccnc4cc3F)n2n1 |w:2.2|
Show InChI InChI=1S/C18H15FN8O/c1-10(22-25-18(20)28)14-4-5-16-23-24-17(27(16)26-14)8-12-7-11-3-2-6-21-15(11)9-13(12)19/h2-7,9H,8H2,1H3,(H3,20,25,28)
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99263
PNG
(US8497368, 55)
Show SMILES CC(=NN1CCOC1=O)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1 |w:2.2|
Show InChI InChI=1S/C19H16N8O2/c1-12(24-26-7-8-29-19(26)28)16-10-21-17-18(22-16)27(25-23-17)11-13-4-5-15-14(9-13)3-2-6-20-15/h2-6,9-10H,7-8,11H2,1H3
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99288
PNG
(US8497368, 80)
Show SMILES CCC(=NNC(N)=O)c1ccc2ncc(Cc3cc4cnn(C)c4cc3F)n2n1 |w:3.3|
Show InChI InChI=1S/C19H19FN8O/c1-3-15(24-25-19(21)29)16-4-5-18-22-10-13(28(18)26-16)7-11-6-12-9-23-27(2)17(12)8-14(11)20/h4-6,8-10H,3,7H2,1-2H3,(H3,21,25,29)
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM302354
PNG
(US8497368, 81)
Show SMILES C\C(=N/NC(N)=O)c1ccc2ncc(Cc3ccc4ncccc4c3)n2n1
Show InChI InChI=1S/C19H17N7O/c1-12(23-24-19(20)27)16-6-7-18-22-11-15(26(18)25-16)10-13-4-5-17-14(9-13)3-2-8-21-17/h2-9,11H,10H2,1H3,(H3,20,24,27)/b23-12+
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n/an/a 4n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439046
PNG
(US10604502, Ex # 34)
Show SMILES Cc1cc2n(CCCO)cc(-c3cccc4NC(C)(C)CCc34)c2cc1C#N
Show InChI InChI=1S/C24H27N3O/c1-16-12-23-20(13-17(16)14-25)21(15-27(23)10-5-11-28)18-6-4-7-22-19(18)8-9-24(2,3)26-22/h4,6-7,12-13,15,26,28H,5,8-11H2,1-3H3
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439056
PNG
(US10604502, Ex # 44)
Show SMILES COC(=O)[C@H]1CC[C@@H](CC1)n1cc(-c2cncc(N)c2Cl)c2cc(C#N)c(C)cc12 |r,wU:7.10,wD:4.3,(5.62,-4.98,;4.59,-6.12,;3.08,-5.8,;2.05,-6.94,;2.61,-4.34,;3.64,-3.19,;3.16,-1.73,;1.66,-1.41,;.62,-2.55,;1.1,-4.02,;1.18,.06,;2.08,1.3,;1.18,2.55,;1.66,4.02,;.62,5.16,;1.1,6.62,;2.61,6.94,;3.64,5.8,;5.14,6.12,;3.16,4.34,;4.19,3.19,;-.29,2.07,;-1.62,2.84,;-2.95,2.07,;-4.29,2.84,;-5.62,3.61,;-2.95,.53,;-4.29,-.24,;-1.62,-.24,;-.29,.53,)|
Show InChI InChI=1S/C23H23ClN4O2/c1-13-7-21-17(8-15(13)9-25)19(18-10-27-11-20(26)22(18)24)12-28(21)16-5-3-14(4-6-16)23(29)30-2/h7-8,10-12,14,16H,3-6,26H2,1-2H3/t14-,16-
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM100705
PNG
(US8507676, 54 | US8507676, 69)
Show SMILES C\C(=N/OCCO)c1ccc2nnc(Cc3c(F)cc4ncccc4c3F)n2n1
Show InChI InChI=1S/C19H16F2N6O2/c1-11(26-29-8-7-28)15-4-5-17-23-24-18(27(17)25-15)9-13-14(20)10-16-12(19(13)21)3-2-6-22-16/h2-6,10,28H,7-9H2,1H3/b26-11+
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n/an/a 4.70n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8507676 (2013)


BindingDB Entry DOI: 10.7270/Q2MS3RC9
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99267
PNG
(US8497368, 59)
Show SMILES CC(N=N)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1
Show InChI InChI=1S/C16H14N8/c1-10(21-17)14-8-19-15-16(20-14)24(23-22-15)9-11-4-5-13-12(7-11)3-2-6-18-13/h2-8,10,17H,9H2,1H3
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Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM99277
PNG
(US8497368, 69)
Show SMILES CC(=NNC(N)=O)c1ccc2ncc(Cc3cc4cnn(C)c4cc3F)n2n1 |w:2.2|
Show InChI InChI=1S/C18H17FN8O/c1-10(23-24-18(20)28)15-3-4-17-21-9-13(27(17)25-15)6-11-5-12-8-22-26(2)16(12)7-14(11)19/h3-5,7-9H,6H2,1-2H3,(H3,20,24,28)
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Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8497368 (2013)


BindingDB Entry DOI: 10.7270/Q2KW5DN7
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439015
PNG
(US10604502, Ex # 3)
Show SMILES Cc1cc2n(cc(-c3cncc(N)c3C(F)F)c2cc1C#N)[C@H]1CC[C@H](O)CC1 |r,wU:22.24,wD:25.28,(-4.33,-.81,;-2.99,-.04,;-1.66,-.81,;-.32,-.04,;1.14,-.51,;2.05,.73,;1.14,1.98,;1.62,3.44,;.59,4.59,;1.06,6.05,;2.57,6.37,;3.6,5.23,;5.1,5.55,;3.12,3.76,;4.15,2.62,;5.66,2.94,;3.68,1.15,;-.32,1.5,;-1.66,2.27,;-2.99,1.5,;-4.33,2.27,;-5.66,3.04,;1.62,-1.98,;3.12,-2.3,;3.6,-3.76,;2.57,-4.91,;3.04,-6.37,;1.06,-4.59,;.59,-3.12,)|
Show InChI InChI=1S/C22H22F2N4O/c1-12-6-20-16(7-13(12)8-25)18(11-28(20)14-2-4-15(29)5-3-14)17-9-27-10-19(26)21(17)22(23)24/h6-7,9-11,14-15,22,29H,2-5,26H2,1H3/t14-,15-
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439036
PNG
(3-(3-amino-2-methylphenyl)-1-(3-hydroxypropyl)-2,6...)
Show SMILES Cc1c(-c2cccc(N)c2C)c2cc(C#N)c(C)cc2n1CCCO |(3.86,.41,;2.32,.41,;1.42,1.66,;1.89,3.12,;.86,4.27,;1.34,5.73,;2.85,6.05,;3.88,4.91,;5.38,5.23,;3.4,3.44,;4.43,2.3,;-.05,1.18,;-1.38,1.95,;-2.71,1.18,;-4.05,1.95,;-5.38,2.72,;-2.71,-.36,;-4.05,-1.13,;-1.38,-1.13,;-.05,-.36,;1.42,-.83,;1.89,-2.3,;.86,-3.44,;1.34,-4.91,;.31,-6.05,)|
Show InChI InChI=1S/C21H23N3O/c1-13-10-20-18(11-16(13)12-22)21(15(3)24(20)8-5-9-25)17-6-4-7-19(23)14(17)2/h4,6-7,10-11,25H,5,8-9,23H2,1-3H3
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439121
PNG
(1-((1R,4R)-1-aminosulfonylcyclohexyl)-6-methyl-3-(...)
Show SMILES Cc1cc2n(cc(-c3cncc(N)c3Cl)c2cc1C#N)[C@H]1CC[C@@H](CC1)S(N)(=O)=O |r,wU:20.22,wD:23.29,(-4.05,-.26,;-2.71,.51,;-1.38,-.26,;-.05,.51,;1.42,.03,;2.32,1.28,;1.42,2.52,;1.89,3.99,;.86,5.13,;1.34,6.6,;2.85,6.92,;3.88,5.77,;5.38,6.09,;3.4,4.31,;4.43,3.16,;-.05,2.05,;-1.38,2.82,;-2.71,2.05,;-4.05,2.82,;-5.38,3.59,;1.89,-1.43,;3.4,-1.75,;3.88,-3.22,;2.85,-4.36,;1.34,-4.04,;.86,-2.58,;3.32,-5.83,;4.81,-6.23,;1.83,-5.43,;2.23,-6.92,)|
Show InChI InChI=1S/C21H22ClN5O2S/c1-12-6-20-16(7-13(12)8-23)18(17-9-26-10-19(24)21(17)22)11-27(20)14-2-4-15(5-3-14)30(25,28)29/h6-7,9-11,14-15H,2-5,24H2,1H3,(H2,25,28,29)/t14-,15-
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439090
PNG
(US10604502, Ex # 78)
Show SMILES Cc1cc2n(cc(-c3cncc(N)c3Cl)c2cc1C#N)-c1ccc(nc1)S(C)(=O)=O
Show InChI InChI=1S/C21H16ClN5O2S/c1-12-5-19-15(6-13(12)7-23)17(16-9-25-10-18(24)21(16)22)11-27(19)14-3-4-20(26-8-14)30(2,28)29/h3-6,8-11H,24H2,1-2H3
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Lysine-specific histone demethylase 1A


(Homo sapiens (Human))
BDBM439107
PNG
(US10604502, Ex # 95)
Show SMILES Cc1cc2n(cc(-c3cccc4NC(C)(C)C=Cc34)c2cc1C#N)[C@H]1CC[C@H](O)CC1 |r,wU:24.27,wD:27.31,c:16,(-5.32,-.81,;-3.98,-.04,;-2.65,-.81,;-1.32,-.04,;.15,-.51,;1.05,.73,;.15,1.98,;.62,3.44,;-.41,4.59,;.07,6.05,;1.58,6.37,;2.61,5.23,;4.11,5.55,;5.14,4.4,;6.65,4.72,;5.54,5.89,;4.67,2.94,;3.16,2.62,;2.13,3.76,;-1.32,1.5,;-2.65,2.27,;-3.98,1.5,;-5.32,2.27,;-6.65,3.04,;.62,-1.98,;2.13,-2.3,;2.61,-3.76,;1.58,-4.91,;2.05,-6.37,;.07,-4.59,;-.41,-3.12,)|
Show InChI InChI=1S/C27H29N3O/c1-17-13-26-23(14-18(17)15-28)24(16-30(26)19-7-9-20(31)10-8-19)21-5-4-6-25-22(21)11-12-27(2,3)29-25/h4-6,11-14,16,19-20,29,31H,7-10H2,1-3H3/t19-,20-
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Novartis AG

US Patent


Assay Description
Representative compounds of the present invention were serially and separately diluted 3-fold in DMSO to obtain a total of twelve concentrations. The...


US Patent US10604502 (2020)


BindingDB Entry DOI: 10.7270/Q2MW2M62
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM100672
PNG
(US8507676, 21)
Show SMILES C\C(=N/O[C@H]1CCN(C1)C(N)=O)c1cnc2nnn(Cc3cc4cccnc4cc3F)c2n1 |r|
Show InChI InChI=1S/C21H20FN9O2/c1-12(28-33-15-4-6-30(11-15)21(23)32)18-9-25-19-20(26-18)31(29-27-19)10-14-7-13-3-2-5-24-17(13)8-16(14)22/h2-3,5,7-9,15H,4,6,10-11H2,1H3,(H2,23,32)/b28-12+/t15-/m0/s1
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Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8507676 (2013)


BindingDB Entry DOI: 10.7270/Q2MS3RC9
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM100670
PNG
(US8507676, 19)
Show SMILES C\C(=N/O[C@H]1CCNC1)c1cnc2nnn(Cc3cc4cccnc4cc3F)c2n1 |r|
Show InChI InChI=1S/C20H19FN8O/c1-12(27-30-15-4-6-22-9-15)18-10-24-19-20(25-18)29(28-26-19)11-14-7-13-3-2-5-23-17(13)8-16(14)21/h2-3,5,7-8,10,15,22H,4,6,9,11H2,1H3/b27-12+/t15-/m0/s1
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Novartis AG

US Patent


Assay Description
The kinase assay is based on the LanthaScreen technology. LanthaScreen is the detection of Time-Resolved Fluorescence Resonance Energy Transfer (TR-...


US Patent US8507676 (2013)


BindingDB Entry DOI: 10.7270/Q2MS3RC9
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568073
PNG
(US11420970, Example 275)
Show SMILES CN1NC(C=C1)[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(F)c(F)c1 |r,c:4|
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Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568076
PNG
(US11420970, Example 278)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCCC(N)(C3)c3ccn(n3)C3CC3)-c3ccc(F)c(F)c3)cnc12
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568077
PNG
(US11420970, Example 279)
Show SMILES Nc1nccc2n(Cc3cc(ncc3N3CCC[C@@H](C3)c3ccn(n3)C(F)F)-c3ccc(F)cc3)cnc12 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568078
PNG
(US11420970, Example 280)
Show SMILES Nc1nccc2n(Cc3cc(ncc3N3CCCC(N)(C3)c3ccn(n3)C3CC3)-c3ccc(F)cc3)cnc12
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568081
PNG
(US11420970, Example 283)
Show SMILES Cn1ncc(n1)[C@H]1CCCN(C1)c1cnc(cc1Cn1cnc2c(N)nccc12)-c1ccc(F)c(F)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568082
PNG
(US11420970, Example 284)
Show SMILES Cc1cc(no1)[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(F)c(F)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568083
PNG
(US11420970, Example 285 | US11420970, Example 289)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@@](N)(C3)[C@@H](F)CO)-c3ccc(F)c(F)c3)cnc12 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568084
PNG
(US11420970, Example 286)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@@](N)(C3)[C@@H](F)CO)-c3cc(F)c(F)cc3F)cnc12 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM568083
PNG
(US11420970, Example 285 | US11420970, Example 289)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@@](N)(C3)[C@@H](F)CO)-c3ccc(F)c(F)c3)cnc12 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567821
PNG
(US11420970, Example 22)
Show SMILES CC(C)(C)OC(=O)NC1(COC2CC2)CCCC(C1)c1cnc(cc1Cn1cnc2c(ncnc12)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)-c1ccc(F)c(F)c1
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567822
PNG
(US11420970, Example 23)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(F)c(F)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567823
PNG
(US11420970, Example 24)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1cccc(F)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567824
PNG
(US11420970, Example 25)
Show SMILES COc1ccc(cc1F)-c1cc(Cn2cnc3c(N)ncnc23)c(cn1)N1CCC[C@](N)(COC(C)C)C1 |r|
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Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567825
PNG
(US11420970, Example 26)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1cc(Cl)ccc1F |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567826
PNG
(US11420970, Example 27)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1cccc(Cl)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567827
PNG
(US11420970, Example 28)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(F)c(Cl)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567828
PNG
(US11420970, Example 29)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(F)cc1F |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567829
PNG
(US11420970, Example 30)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@](N)(COC4CCC4)C3)-c3ccc(F)c(F)c3)cnc12 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567830
PNG
(US11420970, Example 31)
Show SMILES COc1ccc(cc1F)-c1cc(Cn2cnc3c(N)ncnc23)c(cn1)N1CCC[C@](N)(COC2CC2)C1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567831
PNG
(US11420970, Example 32)
Show SMILES COc1ccc(cc1F)-c1cc(Cn2cnc3c(N)ncnc23)c(cn1)N1CCC[C@](N)(COC2CCC2)C1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567832
PNG
(US11420970, Example 33)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(OC)cc1F |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567833
PNG
(US11420970, Example 34)
Show SMILES CC(C)OC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(F)c(F)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567834
PNG
(US11420970, Example 35)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@](N)(COC4CCC4)C3)-c3cccc(F)c3)cnc12 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567837
PNG
(US11420970, Example 38 | US11420970, Example 46)
Show SMILES COC[C@@]1(N)CCCN(C1)c1cnc(cc1Cn1cnc2c(N)ncnc12)-c1ccc(OC)c(F)c1 |r|
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This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567847
PNG
(US11420970, Example 48 | US11420970, Example 53)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@](N)(Cc4nccs4)C3)-c3ccc(F)c(F)c3)cnc12 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a


TBA

Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567848
PNG
(US11420970, Example 49)
Show SMILES Cn1ccc(C[C@@]2(N)CCCN(C2)c2cnc(cc2Cn2cnc3c(N)ncnc23)-c2ccc(F)cc2)n1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a


TBA

Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567849
PNG
(US11420970, Example 50)
Show SMILES COc1ccc(cc1F)-c1cc(Cn2cnc3c(N)ncnc23)c(cn1)N1CCC[C@](N)(Cc2ccccn2)C1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a


TBA

Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567850
PNG
(US11420970, Example 51 | US11420970, Example 54)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@](N)(Cc4ccccn4)C3)-c3ccc(F)c(F)c3)cnc12 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a


TBA

Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase NSD2


(Homo sapiens (Human))
BDBM567851
PNG
(US11420970, Example 52 | US11420970, Example 63)
Show SMILES Nc1ncnc2n(Cc3cc(ncc3N3CCC[C@](N)(Cc4ncco4)C3)-c3ccc(F)c(F)c3)cnc12 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a


TBA

Assay Description
This assay employed LC-MS/MS technology to monitor the SAH production from the NSD2 enzymatic reaction. The enzymatic reaction was performed in white...


Citation and Details

BindingDB Entry DOI: 10.7270/Q27084N0
More data for this
Ligand-Target Pair
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