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Found 8 hits Enz. Inhib. hit(s) with Target = 'Anaplastic lymphoma kinase (ALK WT)' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM50306682
PNG
((R)-3-(1-(2,6-dichloro-3-fluorophenyl)ethoxy)-5-(1...)
Show SMILES C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
Show InChI InChI=1S/C21H22Cl2FN5O/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)/t12-/m1/s1
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Article
PubMed
n/an/a 17.3n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


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Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179803
PNG
(3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(pi...)
Show SMILES CC(Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
Show InChI InChI=1/C21H22Cl2FN5O/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)
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n/an/a 17.6n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179801
PNG
(3-((2,6-dichloro-3-fluorophenyl)thio)-5-(1-(piperi...)
Show SMILES Fc1ccc(Cl)c(Sc2n[nH]c3ncc(cc23)-c2cnn(c2)C2CCNCC2)c1Cl
Show InChI InChI=1S/C20H17Cl2FN6S/c21-15-1-2-16(23)17(22)18(15)30-20-14-7-11(8-25-19(14)27-28-20)12-9-26-29(10-12)13-3-5-24-6-4-13/h1-2,7-10,13,24H,3-6H2,(H,25,27,28)
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n/an/a 135n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179800
PNG
(3-((2,6-dichloro-3-fluorophenyl)sulfide)-5-(1-(pip...)
Show SMILES Fc1ccc(Cl)c(c1Cl)S(=O)c1c[nH]c2ncc(cc12)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1/C21H18Cl2FN5OS/c22-16-1-2-17(24)19(23)20(16)31(30)18-10-27-21-15(18)7-12(8-26-21)13-9-28-29(11-13)14-3-5-25-6-4-14/h1-2,7-11,14,25H,3-6H2,(H,26,27)
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n/an/a 214n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179804
PNG
(3-{[1-(2,6-dichloro-3-fluorophenyl)ethyl]sulfanyl}...)
Show SMILES CC(Sc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
Show InChI InChI=1/C21H22Cl2FN5S/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)
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PubMed
n/an/a 372n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179798
PNG
(3-(1-(2,6-dichloro-3-fluorophenyl)ethyl)-2-methyl-...)
Show SMILES CC(c1c(C)[nH]c2ncc(cc12)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
Show InChI InChI=1/C24H24Cl2FN5/c1-13(22-19(25)3-4-20(27)23(22)26)21-14(2)31-24-18(21)9-15(10-29-24)16-11-30-32(12-16)17-5-7-28-8-6-17/h3-4,9-13,17,28H,5-8H2,1-2H3,(H,29,31)
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n/an/a 504n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179802
PNG
(3-(1-(2,6-dichloro-3-fluorophenyl)cyclopropyl)-5-(...)
Show SMILES Fc1ccc(Cl)c(c1Cl)C1(CC1)c1n[nH]c2ncc(cc12)-c1cnn(c1)C1CCNCC1
Show InChI InChI=1S/C23H21Cl2FN6/c24-17-1-2-18(26)20(25)19(17)23(5-6-23)21-16-9-13(10-28-22(16)31-30-21)14-11-29-32(12-14)15-3-7-27-8-4-15/h1-2,9-12,15,27H,3-8H2,(H,28,30,31)
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PubMed
n/an/a 508n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair
Anaplastic lymphoma kinase (ALK WT)


(Homo sapiens (Human))
BDBM179799
PNG
(4-(4-{2-chloro-3-[1-(2,6-dichloro-3-fluorophenyl)e...)
Show SMILES CC(c1c(Cl)[nH]c2ncc(cc12)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
Show InChI InChI=1/C23H21Cl3FN5/c1-12(20-17(24)2-3-18(27)21(20)25)19-16-8-13(9-29-23(16)31-22(19)26)14-10-30-32(11-14)15-4-6-28-7-5-15/h2-3,8-12,15,28H,4-7H2,1H3,(H,29,31)
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PubMed
n/an/a 2.71E+3n/an/an/an/an/an/a



Tianjin University of Science and Technology



Assay Description
The ALK kinase activity of five target compounds and three positive compounds were evaluated using standard homogeneous time-resolved fluorescence (H...


Citation and Details
More data for this
Ligand-Target Pair