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Found 80 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase V-ABL' AND taxid = 11788   
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
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292494
PNG
(CHEMBL485064 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)Oc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C16H20N5O13P3/c17-14-11-15(19-7-18-14)21(8-20-11)16-13(23)12(22)10(31-16)6-30-35(24,25)33-37(28,29)34-36(26,27)32-9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,22-23H,6H2,(H,24,25)(H,26,27)(H,28,29)(H2,17,18,19)/t10-,12-,13-,16-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292491
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(N)(=O)=O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C17H18N6O7S/c18-14-11-15(21-6-20-14)23(7-22-11)16-13(25)12(24)10(30-16)5-29-17(26)8-1-3-9(4-2-8)31(19,27)28/h1-4,6-7,10,12-13,16,24-25H,5H2,(H2,18,20,21)(H2,19,27,28)/t10-,12-,13-,16-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292492
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES CC(=O)NC(Cc1ccc(OS(=O)(=O)c2ccc(cc2)C(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1)C(N)=O
Show InChI InChI=1S/C28H29N7O10S/c1-14(36)34-19(25(30)39)10-15-2-6-17(7-3-15)45-46(41,42)18-8-4-16(5-9-18)28(40)43-11-20-22(37)23(38)27(44-20)35-13-33-21-24(29)31-12-32-26(21)35/h2-9,12-13,19-20,22-23,27,37-38H,10-11H2,1H3,(H2,30,39)(H,34,36)(H2,29,31,32)/t19?,20-,22-,23-,27-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292493
PNG
(CHEMBL452973 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES CC(=O)NC(Cc1ccc(NP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1)C(N)=O
Show InChI InChI=1S/C21H30N8O17P4/c1-10(30)27-13(19(23)33)6-11-2-4-12(5-3-11)28-47(34,35)44-49(38,39)46-50(40,41)45-48(36,37)42-7-14-16(31)17(32)21(43-14)29-9-26-15-18(22)24-8-25-20(15)29/h2-5,8-9,13-14,16-17,21,31-32H,6-7H2,1H3,(H2,23,33)(H,27,30)(H,36,37)(H,38,39)(H,40,41)(H2,22,24,25)(H2,28,34,35)/t13?,14-,16-,17-,21-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292481
PNG
(4-(2-nitrovinyl)phenyl 4-((S)-1-((S)-1-(2-aminoeth...)
Show SMILES CC(NC(=O)C(C)NC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1)C(=O)NCCN
Show InChI InChI=1S/C23H27N5O8S/c1-15(21(29)25-13-12-24)26-22(30)16(2)27-23(31)18-5-9-20(10-6-18)37(34,35)36-19-7-3-17(4-8-19)11-14-28(32)33/h3-11,14-16H,12-13,24H2,1-2H3,(H3-,25,26,27,29,30,31,34,35)/b14-11+
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292495
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(F)(=O)=O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C17H16FN5O7S/c18-31(27,28)9-3-1-8(2-4-9)17(26)29-5-10-12(24)13(25)16(30-10)23-7-22-11-14(19)20-6-21-15(11)23/h1-4,6-7,10,12-13,16,24-25H,5H2,(H2,19,20,21)/t10-,12-,13-,16-/m1/s1
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292480
PNG
(CHEMBL445698 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Cc1ccc(NP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1
Show InChI InChI=1S/C17H24N6O15P4/c1-9-2-4-10(5-3-9)22-39(26,27)36-41(30,31)38-42(32,33)37-40(28,29)34-6-11-13(24)14(25)17(35-11)23-8-21-12-15(18)19-7-20-16(12)23/h2-5,7-8,11,13-14,17,24-25H,6H2,1H3,(H,28,29)(H,30,31)(H,32,33)(H2,18,19,20)(H2,22,26,27)/t11-,13-,14-,17-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292498
PNG
(CHEMBL486679 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Cc1ccc(NP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1
Show InChI InChI=1S/C17H23N6O12P3/c1-9-2-4-10(5-3-9)22-36(26,27)34-38(30,31)35-37(28,29)32-6-11-13(24)14(25)17(33-11)23-8-21-12-15(18)19-7-20-16(12)23/h2-5,7-8,11,13-14,17,24-25H,6H2,1H3,(H,28,29)(H,30,31)(H2,18,19,20)(H2,22,26,27)/t11-,13-,14-,17-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292497
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(=O)(=O)Oc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C23H21N5O8S/c24-20-17-21(26-11-25-20)28(12-27-17)22-19(30)18(29)16(35-22)10-34-23(31)13-6-8-15(9-7-13)37(32,33)36-14-4-2-1-3-5-14/h1-9,11-12,16,18-19,22,29-30H,10H2,(H2,24,25,26)/t16-,18-,19-,22-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292496
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(=O)(=O)Nc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C23H22N6O7S/c24-20-17-21(26-11-25-20)29(12-27-17)22-19(31)18(30)16(36-22)10-35-23(32)13-6-8-15(9-7-13)37(33,34)28-14-4-2-1-3-5-14/h1-9,11-12,16,18-19,22,28,30-31H,10H2,(H2,24,25,26)/t16-,18-,19-,22-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50007064
PNG
(2-Hydroxy-4-[4-(2-nitro-vinyl)-phenoxysulfonyl]-be...)
Show SMILES OC(=O)c1ccc(cc1O)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H11NO8S/c17-14-9-12(5-6-13(14)15(18)19)25(22,23)24-11-3-1-10(2-4-11)7-8-16(20)21/h1-9H,(H2-,17,18,19,22,23)/b8-7+
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292482
PNG
(({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-...)
Show SMILES CC(=O)NCCNP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C14H24N7O13P3/c1-7(22)16-2-3-20-35(25,26)33-37(29,30)34-36(27,28)31-4-8-10(23)11(24)14(32-8)21-6-19-9-12(15)17-5-18-13(9)21/h5-6,8,10-11,14,23-24H,2-4H2,1H3,(H,16,22)(H,27,28)(H,29,30)(H2,15,17,18)(H2,20,25,26)/t8-,10-,11-,14-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50007072
PNG
(4-(2-nitrovinyl)phenyl 4-(methylcarbamoyl)benzenes...)
Show SMILES CNC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1
Show InChI InChI=1S/C16H14N2O6S/c1-17-16(19)13-4-8-15(9-5-13)25(22,23)24-14-6-2-12(3-7-14)10-11-18(20)21/h2-11H,1H3,(H-,17,19,22,23)/b11-10+
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292483
PNG
(CHEMBL520527 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)Oc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C16H21N5O16P4/c17-14-11-15(19-7-18-14)21(8-20-11)16-13(23)12(22)10(33-16)6-32-38(24,25)35-40(28,29)37-41(30,31)36-39(26,27)34-9-4-2-1-3-5-9/h1-5,7-8,10,12-13,16,22-23H,6H2,(H,24,25)(H,26,27)(H,28,29)(H,30,31)(H2,17,18,19)/t10-,12-,13-,16-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292485
PNG
((S)-2-((S)-2-(4-(4-(2-nitrovinyl)phenoxysulfonyl)b...)
Show SMILES CC(NC(=O)C(C)NC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1)C(O)=O
Show InChI InChI=1S/C21H21N3O9S/c1-13(19(25)23-14(2)21(27)28)22-20(26)16-5-9-18(10-6-16)34(31,32)33-17-7-3-15(4-8-17)11-12-24(29)30/h3-14H,1-2H3,(H3-,22,23,25,26,27,28,31,32)/b12-11+
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50007077
PNG
(4-(2-methoxy-4-(2-nitrovinyl)phenoxysulfonyl)benzo...)
Show SMILES COc1cc(\C=C\[N+]([O-])=O)ccc1O[S+]([O-])(=O)c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C16H13NO8S/c1-24-15-10-11(8-9-17(20)21)2-7-14(15)25-26(22,23)13-5-3-12(4-6-13)16(18)19/h2-10H,1H3,(H-,18,19,22,23)/b9-8+
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292484
PNG
(CHEMBL509039 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES CC(=O)NC(Cc1ccc(NP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1)C(N)=O
Show InChI InChI=1S/C21H29N8O14P3/c1-10(30)27-13(19(23)33)6-11-2-4-12(5-3-11)28-44(34,35)42-46(38,39)43-45(36,37)40-7-14-16(31)17(32)21(41-14)29-9-26-15-18(22)24-8-25-20(15)29/h2-5,8-9,13-14,16-17,21,31-32H,6-7H2,1H3,(H2,23,33)(H,27,30)(H,36,37)(H,38,39)(H2,22,24,25)(H2,28,34,35)/t13?,14-,16-,17-,21-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292486
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(=O)(=O)NCc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C24H24N6O7S/c25-21-18-22(27-12-26-21)30(13-28-18)23-20(32)19(31)17(37-23)11-36-24(33)15-6-8-16(9-7-15)38(34,35)29-10-14-4-2-1-3-5-14/h1-9,12-13,17,19-20,23,29,31-32H,10-11H2,(H2,25,26,27)/t17-,19-,20-,23-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292487
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(=O)(=O)NCCc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C25H26N6O7S/c26-22-19-23(28-13-27-22)31(14-29-19)24-21(33)20(32)18(38-24)12-37-25(34)16-6-8-17(9-7-16)39(35,36)30-11-10-15-4-2-1-3-5-15/h1-9,13-14,18,20-21,24,30,32-33H,10-12H2,(H2,26,27,28)/t18-,20-,21-,24-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292489
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COC(=O)c2ccc(cc2)S(=O)(=O)NCCCc2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C26H28N6O7S/c27-23-20-24(29-14-28-23)32(15-30-20)25-22(34)21(33)19(39-25)13-38-26(35)17-8-10-18(11-9-17)40(36,37)31-12-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-11,14-15,19,21-22,25,31,33-34H,4,7,12-13H2,(H2,27,28,29)/t19-,21-,22-,25-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292490
PNG
(((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihyd...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C18H19N5O7S/c1-31(27,28)10-4-2-9(3-5-10)18(26)29-6-11-13(24)14(25)17(30-11)23-8-22-12-15(19)20-7-21-16(12)23/h2-5,7-8,11,13-14,17,24-25H,6H2,1H3,(H2,19,20,21)/t11-,13-,14-,17-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292499
PNG
(CHEMBL488527 | {[(2R,3S,4R,5R)-5-(6-amino-9H-purin...)
Show SMILES COc1ccc(NP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)cc1
Show InChI InChI=1S/C17H23N6O13P3/c1-32-10-4-2-9(3-5-10)22-37(26,27)35-39(30,31)36-38(28,29)33-6-11-13(24)14(25)17(34-11)23-8-21-12-15(18)19-7-20-16(12)23/h2-5,7-8,11,13-14,17,24-25H,6H2,1H3,(H,28,29)(H,30,31)(H2,18,19,20)(H2,22,26,27)/t11-,13-,14-,17-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3032
PNG
(CHEMBL1204168 | CHEMBL29197 | N-(3-bromophenyl)-6,...)
Show SMILES COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC
Show InChI InChI=1S/C16H14BrN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,19,20)
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n/an/a 30n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3012
PNG
(3-((4-Hydroxyphenyl)amino)-4-((3-chlorophenyl)amin...)
Show SMILES Oc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Show InChI InChI=1S/C17H13ClN6O/c18-10-2-1-3-12(8-10)22-15-14-16(20-9-19-15)23-24-17(14)21-11-4-6-13(25)7-5-11/h1-9,25H,(H3,19,20,21,22,23,24)
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n/an/a 150n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3023
PNG
(3-{4-[(3-chlorophenyl)amino]-1H-pyrazolo[3,4-d]pyr...)
Show SMILES Oc1cccc(c1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C17H12ClN5O/c18-11-4-2-5-12(8-11)21-16-14-15(10-3-1-6-13(24)7-10)22-23-17(14)20-9-19-16/h1-9,24H,(H2,19,20,21,22,23)
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n/an/a 180n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3014
PNG
(3-((3-Hydroxyphenyl)amino)-4-((3-chlorophenyl)amin...)
Show SMILES Oc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Show InChI InChI=1S/C17H13ClN6O/c18-10-3-1-4-11(7-10)21-15-14-16(20-9-19-15)23-24-17(14)22-12-5-2-6-13(25)8-12/h1-9,25H,(H3,19,20,21,22,23,24)
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n/an/a 260n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3005
PNG
(3-((3-Chlorophenyl)amino)-4-amino-1H-pyrazolo[3,4-...)
Show SMILES Nc1ncnc2n[nH]c(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C11H9ClN6/c12-6-2-1-3-7(4-6)16-11-8-9(13)14-5-15-10(8)17-18-11/h1-5H,(H4,13,14,15,16,17,18)
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n/an/a 410n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3016
PNG
(3-((4-Aminophenyl)amino)-4-((3-chlorophenyl)amino)...)
Show SMILES Nc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Show InChI InChI=1S/C17H14ClN7/c18-10-2-1-3-13(8-10)23-15-14-16(21-9-20-15)24-25-17(14)22-12-6-4-11(19)5-7-12/h1-9H,19H2,(H3,20,21,22,23,24,25)
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n/an/a 1.18E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3007
PNG
(3-((3-Chlorophenyl)amino)-4-(phenylamino)-1H-pyraz...)
Show SMILES Clc1cccc(Nc2[nH]nc3ncnc(Nc4ccccc4)c23)c1
Show InChI InChI=1S/C17H13ClN6/c18-11-5-4-8-13(9-11)22-17-14-15(19-10-20-16(14)23-24-17)21-12-6-2-1-3-7-12/h1-10H,(H3,19,20,21,22,23,24)
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n/an/a 1.36E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3009
PNG
(3-((3-Chlorophenyl)amino)-4-((3-bromophenyl)amino)...)
Show SMILES Clc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Br)c4)c23)c1
Show InChI InChI=1S/C17H12BrClN6/c18-10-3-1-5-12(7-10)22-15-14-16(21-9-20-15)24-25-17(14)23-13-6-2-4-11(19)8-13/h1-9H,(H3,20,21,22,23,24,25)
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n/an/a 1.36E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3010
PNG
(3-((3-Chlorophenyl)amino)-4-((3-methylphenyl)amino...)
Show SMILES Cc1cccc(Nc2ncnc3n[nH]c(Nc4cccc(Cl)c4)c23)c1
Show InChI InChI=1S/C18H15ClN6/c1-11-4-2-6-13(8-11)22-16-15-17(21-10-20-16)24-25-18(15)23-14-7-3-5-12(19)9-14/h2-10H,1H3,(H3,20,21,22,23,24,25)
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n/an/a 1.65E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3004
PNG
(3-((3-Chlorophenyl)amino)-4,6-diamino-1H-pyrazolo[...)
Show SMILES Nc1nc(N)c2c(Nc3cccc(Cl)c3)[nH]nc2n1
Show InChI InChI=1S/C11H10ClN7/c12-5-2-1-3-6(4-5)15-9-7-8(13)16-11(14)17-10(7)19-18-9/h1-4H,(H6,13,14,15,16,17,18,19)
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n/an/a 1.90E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3006
PNG
(3,4-Di-(phenylamino)-1H-pyrazolo[3,4-d]pyrimidine ...)
Show SMILES N(c1[nH]nc2ncnc(Nc3ccccc3)c12)c1ccccc1
Show InChI InChI=1S/C17H14N6/c1-3-7-12(8-4-1)20-15-14-16(19-11-18-15)22-23-17(14)21-13-9-5-2-6-10-13/h1-11H,(H3,18,19,20,21,22,23)
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n/an/a 1.96E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3008
PNG
(3,4-Bis((3-chlorophenyl)amino)-1H-pyrazolo[3,4-d]p...)
Show SMILES Clc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Show InChI InChI=1S/C17H12Cl2N6/c18-10-3-1-5-12(7-10)22-15-14-16(21-9-20-15)24-25-17(14)23-13-6-2-4-11(19)8-13/h1-9H,(H3,20,21,22,23,24,25)
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n/an/a 1.98E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3025
PNG
(3-(4-Hydroxyphenyl)-4-((3-chlorophenyl)amino)pyraz...)
Show SMILES Oc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C17H12ClN5O/c18-11-2-1-3-12(8-11)21-16-14-15(10-4-6-13(24)7-5-10)22-23-17(14)20-9-19-16/h1-9,24H,(H2,19,20,21,22,23)
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n/an/a 2.40E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3027
PNG
(3-(3-Aminophenyl)-4-((3-chlorophenyl)amino)-1H-pyr...)
Show SMILES Nc1cccc(c1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C17H13ClN6/c18-11-4-2-6-13(8-11)22-16-14-15(10-3-1-5-12(19)7-10)23-24-17(14)21-9-20-16/h1-9H,19H2,(H2,20,21,22,23,24)
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n/an/a 3.09E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3013
PNG
(3-((3-Methoxyphenyl)amino)-4-((3-chlorophenyl)amin...)
Show SMILES COc1cccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Show InChI InChI=1S/C18H15ClN6O/c1-26-14-7-3-6-13(9-14)23-18-15-16(20-10-21-17(15)24-25-18)22-12-5-2-4-11(19)8-12/h2-10H,1H3,(H3,20,21,22,23,24,25)
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n/an/a 3.40E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3020
PNG
(3-((3-Methoxybenzyl)amino)-4-((3-chlorophenyl)amin...)
Show SMILES COc1cccc(CNc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Show InChI InChI=1S/C19H17ClN6O/c1-27-15-7-2-4-12(8-15)10-21-18-16-17(22-11-23-19(16)26-25-18)24-14-6-3-5-13(20)9-14/h2-9,11H,10H2,1H3,(H3,21,22,23,24,25,26)
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n/an/a 3.50E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3029
PNG
(3-(4-Aminophenyl)-4-((3-chlorophenyl)amino)-1H-pyr...)
Show SMILES Nc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C17H13ClN6/c18-11-2-1-3-13(8-11)22-16-14-15(10-4-6-12(19)7-5-10)23-24-17(14)21-9-20-16/h1-9H,19H2,(H2,20,21,22,23,24)
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n/an/a 3.60E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3022
PNG
(4-(Phenylamino)pyrazolo[3,4-d]pyrimidine deriv. 23...)
Show SMILES Clc1cccc(Nc2ncnc3n[nH]c(-c4ccccc4)c23)c1
Show InChI InChI=1S/C17H12ClN5/c18-12-7-4-8-13(9-12)21-16-14-15(11-5-2-1-3-6-11)22-23-17(14)20-10-19-16/h1-10H,(H2,19,20,21,22,23)
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n/an/a 3.76E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


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More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM50292488
PNG
(4-(2-nitrovinyl)phenyl 4-(2-aminoethylcarbamoyl)be...)
Show SMILES NCCNC(=O)c1ccc(cc1)[S+]([O-])(=O)Oc1ccc(\C=C\[N+]([O-])=O)cc1
Show InChI InChI=1S/C17H17N3O6S/c18-10-11-19-17(21)14-3-7-16(8-4-14)27(24,25)26-15-5-1-13(2-6-15)9-12-20(22)23/h1-9,12H,10-11,18H2,(H-,19,21,24,25)/b12-9+
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n/an/a>5.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Abelson murine leukemia virus p60 v-abl


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More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3018
PNG
(3-(Benzylamino)-4-((3-chlorophenyl)amino)-1H-pyraz...)
Show SMILES Clc1cccc(Nc2ncnc3n[nH]c(NCc4ccccc4)c23)c1
Show InChI InChI=1S/C18H15ClN6/c19-13-7-4-8-14(9-13)23-16-15-17(24-25-18(15)22-11-21-16)20-10-12-5-2-1-3-6-12/h1-9,11H,10H2,(H3,20,21,22,23,24,25)
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PubMed
n/an/a 6.60E+3n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3003
PNG
(1,3-diphenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine |...)
Show SMILES Nc1ncnc2n(nc(-c3ccccc3)c12)-c1ccccc1
Show InChI InChI=1S/C17H13N5/c18-16-14-15(12-7-3-1-4-8-12)21-22(17(14)20-11-19-16)13-9-5-2-6-10-13/h1-11H,(H2,18,19,20)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3011
PNG
(3-((4-Methoxyphenyl)-amino)-4-((3-chlorophenyl)ami...)
Show SMILES COc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Show InChI InChI=1S/C18H15ClN6O/c1-26-14-7-5-12(6-8-14)22-18-15-16(20-10-21-17(15)24-25-18)23-13-4-2-3-11(19)9-13/h2-10H,1H3,(H3,20,21,22,23,24,25)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3015
PNG
(3-((4-(N-BOC-amino)phenyl)amino)-4-((3-chloropheny...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Show InChI InChI=1S/C22H22ClN7O2/c1-22(2,3)32-21(31)28-15-9-7-14(8-10-15)26-20-17-18(24-12-25-19(17)29-30-20)27-16-6-4-5-13(23)11-16/h4-12H,1-3H3,(H,28,31)(H3,24,25,26,27,29,30)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3017
PNG
(3-((4-(Dimethylamino)phenyl)amino)-4-((3-chlorophe...)
Show SMILES CN(C)c1ccc(Nc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Show InChI InChI=1S/C19H18ClN7/c1-27(2)15-8-6-13(7-9-15)23-19-16-17(21-11-22-18(16)25-26-19)24-14-5-3-4-12(20)10-14/h3-11H,1-2H3,(H3,21,22,23,24,25,26)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3019
PNG
(3-((3-Chlorobenzyl)amino)-4-((3-chlorophenyl)amino...)
Show SMILES Clc1cccc(CNc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)c1
Show InChI InChI=1S/C18H14Cl2N6/c19-12-4-1-3-11(7-12)9-21-17-15-16(22-10-23-18(15)26-25-17)24-14-6-2-5-13(20)8-14/h1-8,10H,9H2,(H3,21,22,23,24,25,26)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3021
PNG
(3-((4-Methoxybenzyl)amino)-4-((3-chlorophenyl)amin...)
Show SMILES COc1ccc(CNc2[nH]nc3ncnc(Nc4cccc(Cl)c4)c23)cc1
Show InChI InChI=1S/C19H17ClN6O/c1-27-15-7-5-12(6-8-15)10-21-18-16-17(22-11-23-19(16)26-25-18)24-14-4-2-3-13(20)9-14/h2-9,11H,10H2,1H3,(H3,21,22,23,24,25,26)
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PubMed
n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3026
PNG
(3-(3-Nitrophenyl)-4-((3-chlorophenyl)amino)-1H-pyr...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C17H11ClN6O2/c18-11-4-2-5-12(8-11)21-16-14-15(22-23-17(14)20-9-19-16)10-3-1-6-13(7-10)24(25)26/h1-9H,(H2,19,20,21,22,23)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase V-ABL


(Abelson murine leukemia virus)
BDBM3028
PNG
(3-(4-(BOC-amino)phenyl)-4-((3-chlorophenyl)amino)-...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(cc1)-c1[nH]nc2ncnc(Nc3cccc(Cl)c3)c12
Show InChI InChI=1S/C22H21ClN6O2/c1-22(2,3)31-21(30)27-15-9-7-13(8-10-15)18-17-19(24-12-25-20(17)29-28-18)26-16-6-4-5-14(23)11-16/h4-12H,1-3H3,(H,27,30)(H2,24,25,26,28,29)
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n/an/a>1.00E+4n/an/an/an/a7.520



Novartis Pharmaceuticals



Assay Description
IC50 is the inhibitor concentration which inhibits 50% of kinase activity that catalyzes the transfer of the terminal phosphate from [gamma-32P] labe...


Citation and Details
More data for this
Ligand-Target Pair
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