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PubMed code 26385444

Compile data set for download or QSAR
Found 74 hits of Enzyme Inhibition Constant Data   
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
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50101817
PNG
(Adalat | Adalat Cc | Afeditab Cr | BAY-A-1040 | CH...)
Show SMILES COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OC |c:4,9|
Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,18H,1-4H3
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n/an/a 2.02E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120619
PNG
(CHEMBL3618287)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1cccc(c1)[N+]([O-])=O |c:3,t:6|
Show InChI InChI=1/C19H15N3O3S/c1-11-17(12(2)23)18(13-6-5-7-14(10-13)22(24)25)21-15-8-3-4-9-16(15)26-19(21)20-11/h3-10,18H,1-2H3
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n/an/a 2.04E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120606
PNG
(CHEMBL3618288)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(cc1)[N+]([O-])=O |c:3,t:6|
Show InChI InChI=1/C19H15N3O3S/c1-11-17(12(2)23)18(13-7-9-14(10-8-13)22(24)25)21-15-5-3-4-6-16(15)26-19(21)20-11/h3-10,18H,1-2H3
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n/an/a 2.04E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120591
PNG
(CHEMBL3618297)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1cccc(c1)[N+]([O-])=O |c:4,t:7|
Show InChI InChI=1/C20H17N3O3S/c1-3-16(24)18-12(2)21-20-22(15-9-4-5-10-17(15)27-20)19(18)13-7-6-8-14(11-13)23(25)26/h4-11,19H,3H2,1-2H3
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n/an/a 2.10E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120620
PNG
(CHEMBL3618286)
Show SMILES COc1ccc(cc1)C1N2C(Sc3ccccc23)=NC(C)=C1C(C)=O |c:20,23|
Show InChI InChI=1/C20H18N2O2S/c1-12-18(13(2)23)19(14-8-10-15(24-3)11-9-14)22-16-6-4-5-7-17(16)25-20(22)21-12/h4-11,19H,1-3H3
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n/an/a 2.14E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120590
PNG
(CHEMBL3618296)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(OC)cc1 |c:4,t:7|
Show InChI InChI=1/C21H20N2O2S/c1-4-17(24)19-13(2)22-21-23(16-7-5-6-8-18(16)26-21)20(19)14-9-11-15(25-3)12-10-14/h5-12,20H,4H2,1-3H3
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n/an/a 2.17E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120592
PNG
(CHEMBL3618298)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(cc1)[N+]([O-])=O |c:4,t:7|
Show InChI InChI=1/C20H17N3O3S/c1-3-16(24)18-12(2)21-20-22(15-6-4-5-7-17(15)27-20)19(18)13-8-10-14(11-9-13)23(25)26/h4-11,19H,3H2,1-2H3
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n/an/a 3.04E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120615
PNG
(CHEMBL3618290)
Show SMILES COc1cc(ccc1O)C1N2C(Sc3ccccc23)=NC(C)=C1C(C)=O |c:21,24|
Show InChI InChI=1/C20H18N2O3S/c1-11-18(12(2)23)19(13-8-9-15(24)16(10-13)25-3)22-14-6-4-5-7-17(14)26-20(22)21-11/h4-10,19,24H,1-3H3
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n/an/a 3.67E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120594
PNG
(CHEMBL3618300)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(O)c(OC)c1 |c:4,t:7|
Show InChI InChI=1/C21H20N2O3S/c1-4-15(24)19-12(2)22-21-23(14-7-5-6-8-18(14)27-21)20(19)13-9-10-16(25)17(11-13)26-3/h5-11,20,25H,4H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120614
PNG
(CHEMBL551014)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(OC)cc1 |c:5|
Show InChI InChI=1/C25H30N2O6/c1-6-33-24(29)22-16(2)26-25(32-5)27(23(22)18-9-13-20(31-4)14-10-18)15-21(28)17-7-11-19(30-3)12-8-17/h7-14,23,25-26H,6,15H2,1-5H3
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n/an/a 4.10E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120587
PNG
(CHEMBL3618285)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(O)cc1 |c:3,t:6|
Show InChI InChI=1/C19H16N2O2S/c1-11-17(12(2)22)18(13-7-9-14(23)10-8-13)21-15-5-3-4-6-16(15)24-19(21)20-11/h3-10,18,23H,1-2H3
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n/an/a 4.21E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120585
PNG
(CHEMBL3618284)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1O |c:3,t:6|
Show InChI InChI=1/C19H16N2O2S/c1-11-17(12(2)22)18(13-7-3-5-9-15(13)23)21-14-8-4-6-10-16(14)24-19(21)20-11/h3-10,18,23H,1-2H3
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n/an/a 4.30E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120607
PNG
(CHEMBL3618289)
Show SMILES CN(C)c1ccc(cc1)C1N2C(Sc3ccccc23)=NC(C)=C1C(C)=O |c:21,24|
Show InChI InChI=1/C21H21N3OS/c1-13-19(14(2)25)20(15-9-11-16(12-10-15)23(3)4)24-17-7-5-6-8-18(17)26-21(24)22-13/h5-12,20H,1-4H3
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n/an/a 4.37E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120588
PNG
(CHEMBL3618294)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1O |c:4,t:7|
Show InChI InChI=1/C20H18N2O2S/c1-3-15(23)18-12(2)21-20-22(14-9-5-7-11-17(14)25-20)19(18)13-8-4-6-10-16(13)24/h4-11,19,24H,3H2,1-2H3
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n/an/a 4.70E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120611
PNG
(CHEMBL558858)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(C)cc1 |c:5|
Show InChI InChI=1/C25H30N2O5/c1-6-32-24(29)22-17(3)26-25(31-5)27(23(22)19-9-7-16(2)8-10-19)15-21(28)18-11-13-20(30-4)14-12-18/h7-14,23,25-26H,6,15H2,1-5H3
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n/an/a 5.10E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120589
PNG
(CHEMBL3618295)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(O)cc1 |c:4,t:7|
Show InChI InChI=1/C20H18N2O2S/c1-3-16(24)18-12(2)21-20-22(15-6-4-5-7-17(15)25-20)19(18)13-8-10-14(23)11-9-13/h4-11,19,23H,3H2,1-2H3
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n/an/a 5.90E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120584
PNG
(CHEMBL3618283)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(F)cc1 |c:3,t:6|
Show InChI InChI=1/C19H15FN2OS/c1-11-17(12(2)23)18(13-7-9-14(20)10-8-13)22-15-5-3-4-6-16(15)24-19(22)21-11/h3-10,18H,1-2H3
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n/an/a 7.30E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120593
PNG
(CHEMBL3618299)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(cc1)N(C)C |c:4,t:7|
Show InChI InChI=1/C22H23N3OS/c1-5-18(26)20-14(2)23-22-25(17-8-6-7-9-19(17)27-22)21(20)15-10-12-16(13-11-15)24(3)4/h6-13,21H,5H2,1-4H3
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n/an/a 7.37E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120612
PNG
(CHEMBL563385)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(OC)cc1 |c:5|
Show InChI InChI=1/C24H28N2O5/c1-5-31-23(28)21-16(2)25-24(30-4)26(15-20(27)17-9-7-6-8-10-17)22(21)18-11-13-19(29-3)14-12-18/h6-14,22,24-25H,5,15H2,1-4H3
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n/an/a 7.40E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120605
PNG
(CHEMBL3618282)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(Cl)cc1 |c:3,t:6|
Show InChI InChI=1/C19H15ClN2OS/c1-11-17(12(2)23)18(13-7-9-14(20)10-8-13)22-15-5-3-4-6-16(15)24-19(22)21-11/h3-10,18H,1-2H3
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n/an/a 9.10E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120608
PNG
(CHEMBL550811)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(O)cc1 |c:5|
Show InChI InChI=1/C24H28N2O6/c1-5-32-23(29)21-15(2)25-24(31-4)26(22(21)17-6-10-18(27)11-7-17)14-20(28)16-8-12-19(30-3)13-9-16/h6-13,22,24-25,27H,5,14H2,1-4H3
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n/an/a 9.80E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120604
PNG
(CHEMBL3618203)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1Cl |c:3,t:6|
Show InChI InChI=1/C19H15ClN2OS/c1-11-17(12(2)23)18(13-7-3-4-8-14(13)20)22-15-9-5-6-10-16(15)24-19(22)21-11/h3-10,18H,1-2H3
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n/an/a 9.80E+3n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120602
PNG
(CHEMBL564992)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(O)cc1 |c:5|
Show InChI InChI=1/C23H26N2O5/c1-4-30-22(28)20-15(2)24-23(29-3)25(14-19(27)16-8-6-5-7-9-16)21(20)17-10-12-18(26)13-11-17/h5-13,21,23-24,26H,4,14H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120616
PNG
(CHEMBL3618291)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1Cl |c:4,t:7|
Show InChI InChI=1/C20H17ClN2OS/c1-3-16(24)18-12(2)22-20-23(15-10-6-7-11-17(15)25-20)19(18)13-8-4-5-9-14(13)21/h4-11,19H,3H2,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120617
PNG
(CHEMBL3618292)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(Cl)cc1 |c:4,t:7|
Show InChI InChI=1/C20H17ClN2OS/c1-3-16(24)18-12(2)22-20-23(15-6-4-5-7-17(15)25-20)19(18)13-8-10-14(21)11-9-13/h4-11,19H,3H2,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120618
PNG
(CHEMBL3618293)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(F)cc1 |c:4,t:7|
Show InChI InChI=1/C20H17FN2OS/c1-3-16(24)18-12(2)22-20-23(15-6-4-5-7-17(15)25-20)19(18)13-8-10-14(21)11-9-13/h4-11,19H,3H2,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120598
PNG
(CHEMBL564764)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccccc1 |c:5|
Show InChI InChI=1/C24H28N2O5/c1-5-31-23(28)21-16(2)25-24(30-4)26(22(21)18-9-7-6-8-10-18)15-20(27)17-11-13-19(29-3)14-12-17/h6-14,22,24-25H,5,15H2,1-4H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120603
PNG
(CHEMBL550810)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(O)cc1 |c:5|
Show InChI InChI=1/C23H25ClN2O5/c1-4-31-22(29)20-14(2)25-23(30-3)26(21(20)16-7-11-18(27)12-8-16)13-19(28)15-5-9-17(24)10-6-15/h5-12,21,23,25,27H,4,13H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120601
PNG
(CHEMBL3618202)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(Cl)cc1 |c:5|
Show InChI InChI=1/C24H27ClN2O5/c1-5-32-23(29)21-15(2)26-24(31-4)27(22(21)17-6-10-18(25)11-7-17)14-20(28)16-8-12-19(30-3)13-9-16/h6-13,22,24,26H,5,14H2,1-4H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120609
PNG
(CHEMBL558723)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(C)cc1 |c:5|
Show InChI InChI=1/C24H28N2O4/c1-5-30-23(28)21-17(3)25-24(29-4)26(15-20(27)18-9-7-6-8-10-18)22(21)19-13-11-16(2)12-14-19/h6-14,22,24-25H,5,15H2,1-4H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120596
PNG
(CHEMBL562342)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccccc1 |c:5|
Show InChI InChI=1/C23H26N2O4/c1-4-29-22(27)20-16(2)24-23(28-3)25(21(20)18-13-9-6-10-14-18)15-19(26)17-11-7-5-8-12-17/h5-14,21,23-24H,4,15H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120610
PNG
(CHEMBL558925)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(C)cc1 |c:5|
Show InChI InChI=1/C24H27ClN2O4/c1-5-31-23(29)21-16(3)26-24(30-4)27(22(21)18-8-6-15(2)7-9-18)14-20(28)17-10-12-19(25)13-11-17/h6-13,22,24,26H,5,14H2,1-4H3
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n/an/a 2.92E+4n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120613
PNG
(CHEMBL558859)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(OC)cc1 |c:5|
Show InChI InChI=1/C24H27ClN2O5/c1-5-32-23(29)21-15(2)26-24(31-4)27(14-20(28)16-6-10-18(25)11-7-16)22(21)17-8-12-19(30-3)13-9-17/h6-13,22,24,26H,5,14H2,1-4H3
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n/an/a 3.03E+4n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120599
PNG
(CHEMBL558460)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(Cl)cc1 |c:5|
Show InChI InChI=1/C23H25ClN2O4/c1-4-30-22(28)20-15(2)25-23(29-3)26(14-19(27)16-8-6-5-7-9-16)21(20)17-10-12-18(24)13-11-17/h5-13,21,23,25H,4,14H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120597
PNG
(CHEMBL563281)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccccc1 |c:5|
Show InChI InChI=1/C23H25ClN2O4/c1-4-30-22(28)20-15(2)25-23(29-3)26(21(20)17-8-6-5-7-9-17)14-19(27)16-10-12-18(24)13-11-16/h5-13,21,23,25H,4,14H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120600
PNG
(CHEMBL550608)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(Cl)cc1 |c:5|
Show InChI InChI=1/C23H24Cl2N2O4/c1-4-31-22(29)20-14(2)26-23(30-3)27(21(20)16-7-11-18(25)12-8-16)13-19(28)15-5-9-17(24)10-6-15/h5-12,21,23,26H,4,13H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120622
PNG
(CHEMBL1304613)
Show SMILES Cc1cc(C)nc(Nc2nc3ccccc3s2)n1
Show InChI InChI=1S/C13H12N4S/c1-8-7-9(2)15-12(14-8)17-13-16-10-5-3-4-6-11(10)18-13/h3-7H,1-2H3,(H,14,15,16,17)
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120621
PNG
(CHEMBL1609840)
Show SMILES CC(=O)c1c(C)nc(Nc2nc3ccccc3s2)nc1C
Show InChI InChI=1S/C15H14N4OS/c1-8-13(10(3)20)9(2)17-14(16-8)19-15-18-11-6-4-5-7-12(11)21-15/h4-7H,1-3H3,(H,16,17,18,19)
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120595
PNG
(CHEMBL3618301)
Show SMILES CCc1nc(Nc2nc3ccccc3s2)nc(C)c1C(C)=O
Show InChI InChI=1S/C16H16N4OS/c1-4-11-14(10(3)21)9(2)17-15(18-11)20-16-19-12-7-5-6-8-13(12)22-16/h5-8H,4H2,1-3H3,(H,17,18,19,20)
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120606
PNG
(CHEMBL3618288)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(cc1)[N+]([O-])=O |c:3,t:6|
Show InChI InChI=1/C19H15N3O3S/c1-11-17(12(2)23)18(13-7-9-14(10-8-13)22(24)25)21-15-5-3-4-6-16(15)26-19(21)20-11/h3-10,18H,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120619
PNG
(CHEMBL3618287)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1cccc(c1)[N+]([O-])=O |c:3,t:6|
Show InChI InChI=1/C19H15N3O3S/c1-11-17(12(2)23)18(13-6-5-7-14(10-13)22(24)25)21-15-8-3-4-9-16(15)26-19(21)20-11/h3-10,18H,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120591
PNG
(CHEMBL3618297)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1cccc(c1)[N+]([O-])=O |c:4,t:7|
Show InChI InChI=1/C20H17N3O3S/c1-3-16(24)18-12(2)21-20-22(15-9-4-5-10-17(15)27-20)19(18)13-7-6-8-14(11-13)23(25)26/h4-11,19H,3H2,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120620
PNG
(CHEMBL3618286)
Show SMILES COc1ccc(cc1)C1N2C(Sc3ccccc23)=NC(C)=C1C(C)=O |c:20,23|
Show InChI InChI=1/C20H18N2O2S/c1-12-18(13(2)23)19(14-8-10-15(24-3)11-9-14)22-16-6-4-5-7-17(16)25-20(22)21-12/h4-11,19H,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120590
PNG
(CHEMBL3618296)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(OC)cc1 |c:4,t:7|
Show InChI InChI=1/C21H20N2O2S/c1-4-17(24)19-13(2)22-21-23(16-7-5-6-8-18(16)26-21)20(19)14-9-11-15(25-3)12-10-14/h5-12,20H,4H2,1-3H3
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n/an/a 2.17E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120592
PNG
(CHEMBL3618298)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(cc1)[N+]([O-])=O |c:4,t:7|
Show InChI InChI=1/C20H17N3O3S/c1-3-16(24)18-12(2)21-20-22(15-6-4-5-7-17(15)27-20)19(18)13-8-10-14(11-9-13)23(25)26/h4-11,19H,3H2,1-2H3
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n/an/a 3.04E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120615
PNG
(CHEMBL3618290)
Show SMILES COc1cc(ccc1O)C1N2C(Sc3ccccc23)=NC(C)=C1C(C)=O |c:21,24|
Show InChI InChI=1/C20H18N2O3S/c1-11-18(12(2)23)19(13-8-9-15(24)16(10-13)25-3)22-14-6-4-5-7-17(14)26-20(22)21-11/h4-10,19,24H,1-3H3
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n/an/a 3.67E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120594
PNG
(CHEMBL3618300)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(O)c(OC)c1 |c:4,t:7|
Show InChI InChI=1/C21H20N2O3S/c1-4-15(24)19-12(2)22-21-23(14-7-5-6-8-18(14)27-21)20(19)13-9-10-16(25)17(11-13)26-3/h5-11,20,25H,4H2,1-3H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120614
PNG
(CHEMBL551014)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(OC)cc1 |c:5|
Show InChI InChI=1/C25H30N2O6/c1-6-33-24(29)22-16(2)26-25(32-5)27(23(22)18-9-13-20(31-4)14-10-18)15-21(28)17-7-11-19(30-3)12-8-17/h7-14,23,25-26H,6,15H2,1-5H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120587
PNG
(CHEMBL3618285)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(O)cc1 |c:3,t:6|
Show InChI InChI=1/C19H16N2O2S/c1-11-17(12(2)22)18(13-7-9-14(23)10-8-13)21-15-5-3-4-6-16(15)24-19(21)20-11/h3-10,18,23H,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120585
PNG
(CHEMBL3618284)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1O |c:3,t:6|
Show InChI InChI=1/C19H16N2O2S/c1-11-17(12(2)22)18(13-7-3-5-9-15(13)23)21-14-8-4-6-10-16(14)24-19(21)20-11/h3-10,18,23H,1-2H3
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n/an/a 4.30E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120607
PNG
(CHEMBL3618289)
Show SMILES CN(C)c1ccc(cc1)C1N2C(Sc3ccccc23)=NC(C)=C1C(C)=O |c:21,24|
Show InChI InChI=1/C21H21N3OS/c1-13-19(14(2)25)20(15-9-11-16(12-10-15)23(3)4)24-17-7-5-6-8-18(17)26-21(24)22-13/h5-12,20H,1-4H3
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n/an/a 4.37E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120588
PNG
(CHEMBL3618294)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1O |c:4,t:7|
Show InChI InChI=1/C20H18N2O2S/c1-3-15(23)18-12(2)21-20-22(14-9-5-7-11-17(14)25-20)19(18)13-8-4-6-10-16(13)24/h4-11,19,24H,3H2,1-2H3
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n/an/a 4.70E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120611
PNG
(CHEMBL558858)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(C)cc1 |c:5|
Show InChI InChI=1/C25H30N2O5/c1-6-32-24(29)22-17(3)26-25(31-5)27(23(22)19-9-7-16(2)8-10-19)15-21(28)18-11-13-20(30-4)14-12-18/h7-14,23,25-26H,6,15H2,1-5H3
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n/an/a 5.10E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120589
PNG
(CHEMBL3618295)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(O)cc1 |c:4,t:7|
Show InChI InChI=1/C20H18N2O2S/c1-3-16(24)18-12(2)21-20-22(15-6-4-5-7-17(15)25-20)19(18)13-8-10-14(23)11-9-13/h4-11,19,23H,3H2,1-2H3
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n/an/a 5.90E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120584
PNG
(CHEMBL3618283)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(F)cc1 |c:3,t:6|
Show InChI InChI=1/C19H15FN2OS/c1-11-17(12(2)23)18(13-7-9-14(20)10-8-13)22-15-5-3-4-6-16(15)24-19(22)21-11/h3-10,18H,1-2H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120593
PNG
(CHEMBL3618299)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(cc1)N(C)C |c:4,t:7|
Show InChI InChI=1/C22H23N3OS/c1-5-18(26)20-14(2)23-22-25(17-8-6-7-9-19(17)27-22)21(20)15-10-12-16(13-11-15)24(3)4/h6-13,21H,5H2,1-4H3
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n/an/a 7.37E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120612
PNG
(CHEMBL563385)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(OC)cc1 |c:5|
Show InChI InChI=1/C24H28N2O5/c1-5-31-23(28)21-16(2)25-24(30-4)26(15-20(27)17-9-7-6-8-10-17)22(21)18-11-13-19(29-3)14-12-18/h6-14,22,24-25H,5,15H2,1-4H3
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Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120605
PNG
(CHEMBL3618282)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(Cl)cc1 |c:3,t:6|
Show InChI InChI=1/C19H15ClN2OS/c1-11-17(12(2)23)18(13-7-9-14(20)10-8-13)22-15-5-3-4-6-16(15)24-19(22)21-11/h3-10,18H,1-2H3
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n/an/a 9.10E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120604
PNG
(CHEMBL3618203)
Show SMILES CC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1Cl |c:3,t:6|
Show InChI InChI=1/C19H15ClN2OS/c1-11-17(12(2)23)18(13-7-3-4-8-14(13)20)22-15-9-5-6-10-16(15)24-19(22)21-11/h3-10,18H,1-2H3
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n/an/a 9.80E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120608
PNG
(CHEMBL550811)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(O)cc1 |c:5|
Show InChI InChI=1/C24H28N2O6/c1-5-32-23(29)21-15(2)25-24(31-4)26(22(21)17-6-10-18(27)11-7-17)14-20(28)16-8-12-19(30-3)13-9-16/h6-13,22,24-25,27H,5,14H2,1-4H3
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n/an/a 9.80E+10n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120602
PNG
(CHEMBL564992)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(O)cc1 |c:5|
Show InChI InChI=1/C23H26N2O5/c1-4-30-22(28)20-15(2)24-23(29-3)25(14-19(27)16-8-6-5-7-9-16)21(20)17-10-12-18(26)13-11-17/h5-13,21,23-24,26H,4,14H2,1-3H3
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n/an/a 1.02E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120616
PNG
(CHEMBL3618291)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccccc1Cl |c:4,t:7|
Show InChI InChI=1/C20H17ClN2OS/c1-3-16(24)18-12(2)22-20-23(15-10-6-7-11-17(15)25-20)19(18)13-8-4-5-9-14(13)21/h4-11,19H,3H2,1-2H3
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n/an/a 1.08E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120617
PNG
(CHEMBL3618292)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(Cl)cc1 |c:4,t:7|
Show InChI InChI=1/C20H17ClN2OS/c1-3-16(24)18-12(2)22-20-23(15-6-4-5-7-17(15)25-20)19(18)13-8-10-14(21)11-9-13/h4-11,19H,3H2,1-2H3
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n/an/a 1.11E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120598
PNG
(CHEMBL564764)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccccc1 |c:5|
Show InChI InChI=1/C24H28N2O5/c1-5-31-23(28)21-16(2)25-24(30-4)26(22(21)18-9-7-6-8-10-18)15-20(27)17-11-13-19(29-3)14-12-17/h6-14,22,24-25H,5,15H2,1-4H3
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n/an/a 1.33E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120618
PNG
(CHEMBL3618293)
Show SMILES CCC(=O)C1=C(C)N=C2Sc3ccccc3N2C1c1ccc(F)cc1 |c:4,t:7|
Show InChI InChI=1/C20H17FN2OS/c1-3-16(24)18-12(2)22-20-23(15-6-4-5-7-17(15)25-20)19(18)13-8-10-14(21)11-9-13/h4-11,19H,3H2,1-2H3
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n/an/a 1.33E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120603
PNG
(CHEMBL550810)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(O)cc1 |c:5|
Show InChI InChI=1/C23H25ClN2O5/c1-4-31-22(29)20-14(2)25-23(30-3)26(21(20)16-7-11-18(27)12-8-16)13-19(28)15-5-9-17(24)10-6-15/h5-12,21,23,25,27H,4,13H2,1-3H3
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n/an/a 1.52E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120601
PNG
(CHEMBL3618202)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(OC)cc2)C1c1ccc(Cl)cc1 |c:5|
Show InChI InChI=1/C24H27ClN2O5/c1-5-32-23(29)21-15(2)26-24(31-4)27(22(21)17-6-10-18(25)11-7-17)14-20(28)16-8-12-19(30-3)13-9-16/h6-13,22,24,26H,5,14H2,1-4H3
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n/an/a 1.82E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120609
PNG
(CHEMBL558723)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(C)cc1 |c:5|
Show InChI InChI=1/C24H28N2O4/c1-5-30-23(28)21-17(3)25-24(29-4)26(15-20(27)18-9-7-6-8-10-18)22(21)19-13-11-16(2)12-14-19/h6-14,22,24-25H,5,15H2,1-4H3
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n/an/a 1.92E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120596
PNG
(CHEMBL562342)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccccc1 |c:5|
Show InChI InChI=1/C23H26N2O4/c1-4-29-22(27)20-16(2)24-23(28-3)25(21(20)18-13-9-6-10-14-18)15-19(26)17-11-7-5-8-12-17/h5-14,21,23-24H,4,15H2,1-3H3
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n/an/a 2.33E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120610
PNG
(CHEMBL558925)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(C)cc1 |c:5|
Show InChI InChI=1/C24H27ClN2O4/c1-5-31-23(29)21-16(3)26-24(30-4)27(22(21)18-8-6-15(2)7-9-18)14-20(28)17-10-12-19(25)13-11-17/h6-13,22,24,26H,5,14H2,1-4H3
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n/an/a 2.92E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120613
PNG
(CHEMBL558859)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(OC)cc1 |c:5|
Show InChI InChI=1/C24H27ClN2O5/c1-5-32-23(29)21-15(2)26-24(31-4)27(14-20(28)16-6-10-18(25)11-7-16)22(21)17-8-12-19(30-3)13-9-17/h6-13,22,24,26H,5,14H2,1-4H3
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n/an/a 3.03E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120599
PNG
(CHEMBL558460)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccccc2)C1c1ccc(Cl)cc1 |c:5|
Show InChI InChI=1/C23H25ClN2O4/c1-4-30-22(28)20-15(2)25-23(29-3)26(14-19(27)16-8-6-5-7-9-16)21(20)17-10-12-18(24)13-11-17/h5-13,21,23,25H,4,14H2,1-3H3
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n/an/a 3.13E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120597
PNG
(CHEMBL563281)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccccc1 |c:5|
Show InChI InChI=1/C23H25ClN2O4/c1-4-30-22(28)20-15(2)25-23(29-3)26(21(20)17-8-6-5-7-9-17)14-19(27)16-10-12-18(24)13-11-16/h5-13,21,23,25H,4,14H2,1-3H3
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n/an/a 3.33E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50120600
PNG
(CHEMBL550608)
Show SMILES CCOC(=O)C1=C(C)NC(OC)N(CC(=O)c2ccc(Cl)cc2)C1c1ccc(Cl)cc1 |c:5|
Show InChI InChI=1/C23H24Cl2N2O4/c1-4-31-22(29)20-14(2)26-23(30-3)27(21(20)16-7-11-18(25)12-8-16)13-19(28)15-5-9-17(24)10-6-15/h5-12,21,23,26H,4,13H2,1-3H3
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n/an/a 4.13E+11n/an/an/an/an/an/a



Rashtrasant Tukadoji Maharaj Nagpur University

Curated by ChEMBL


Assay Description
Inhibition of MLCK (unknown origin) incubated for 15 mins using [gamma-32P]-ATP by scintillation counting method


Bioorg Med Chem 23: 6689-713 (2015)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%