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Compile Data Set for Download or QSAR

Found 12 hits of ki for UniProtKB: Q16566   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223209
PNG
(8-((6-Chloropyrimidin-4-yl)oxy)quinoline (Compound...)
Show SMILES Clc1cc(Oc2cccc3cccnc23)ncn1
Show InChI InChI=1S/C13H8ClN3O/c14-11-7-12(17-8-16-11)18-10-5-1-3-9-4-2-6-15-13(9)10/h1-8H
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UniChem
Article
PubMed
 0.0109n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV


(Homo sapiens (Human))		BDBM50341519
PNG
((S)-3-(4-(2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl...)
Show SMILES CNc1cncc(n1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1 |r|
Show InChI InChI=1S/C26H31N7O2/c1-27-24-16-28-15-23(30-24)19-13-22(26(35)29-14-19)31-25(34)18-6-8-20(9-7-18)33-12-4-5-21(33)17-32-10-2-3-11-32/h6-9,13-16,21H,2-5,10-12,17H2,1H3,(H,27,30)(H,29,35)(H,31,34)/t21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals (Europe) Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CAMK4

J Med Chem 54: 2341-50 (2011)


Article DOI: 10.1021/jm101499u
BindingDB Entry DOI: 10.7270/Q2KH0NPW
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223208
PNG
(7-((6-((5-Methoxy-1H-benzo[d]imidazol-2-yl)thio)py...)
Show SMILES COc1ccc2[nH]c(Sc3cc(Oc4ccc5c(C)cc(=O)oc5c4)ncn3)nc2c1
Show InChI InChI=1S/C22H16N4O4S/c1-12-7-21(27)30-18-9-14(3-5-15(12)18)29-19-10-20(24-11-23-19)31-22-25-16-6-4-13(28-2)8-17(16)26-22/h3-11H,1-2H3,(H,25,26)
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 1.35E+3n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223207
PNG
(4-Methyl-7-((6-(quinolin-8-yloxy)pyrimidin-4-yl)ox...)
Show SMILES Cc1cc(=O)oc2cc(Oc3cc(Oc4cccc5cccnc45)ncn3)ccc12
Show InChI InChI=1S/C23H15N3O4/c1-14-10-22(27)30-19-11-16(7-8-17(14)19)28-20-12-21(26-13-25-20)29-18-6-2-4-15-5-3-9-24-23(15)18/h2-13H,1H3
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 1.45E+3n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV


(Homo sapiens (Human))		BDBM50463483
PNG
(CHEMBL4245242)
Show SMILES O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
Show InChI InChI=1S/C26H29N5O2S/c32-24(31-26-30-23(17-34-26)22-16-29-25-21(22)7-2-10-28-25)15-19-4-1-6-20(14-19)33-13-3-5-18-8-11-27-12-9-18/h1-2,4,6-7,10,14,16-18,27H,3,5,8-9,11-13,15H2,(H,28,29)(H,30,31,32)
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>2.00E+3n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibition of CamK4 (unknown origin)

Bioorg Med Chem Lett 28: 2622-2626 (2018)


Article DOI: 10.1016/j.bmcl.2018.06.040
BindingDB Entry DOI: 10.7270/Q2ZC85HX
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV


(Homo sapiens (Human))		BDBM50463479
PNG
(CHEMBL4249925)
Show SMILES CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
Show InChI InChI=1S/C19H17N5O3S2/c1-29(26,27)24-13-5-2-4-12(8-13)9-17(25)23-19-22-16(11-28-19)15-10-21-18-14(15)6-3-7-20-18/h2-8,10-11,24H,9H2,1H3,(H,20,21)(H,22,23,25)
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>2.00E+3n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibition of CamK4 (unknown origin)

Bioorg Med Chem Lett 28: 2622-2626 (2018)


Article DOI: 10.1016/j.bmcl.2018.06.040
BindingDB Entry DOI: 10.7270/Q2ZC85HX
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223206
PNG
(7-[(6-Chloropyrimidin-4-yl)oxy]-4-methyl-2H-chrome...)
Show SMILES Cc1cc(=O)oc2cc(Oc3cc(Cl)ncn3)ccc12
Show InChI InChI=1S/C14H9ClN2O3/c1-8-4-14(18)20-11-5-9(2-3-10(8)11)19-13-6-12(15)16-7-17-13/h2-7H,1H3
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 3.57E+3n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV


(Homo sapiens (Human))		BDBM50402020
PNG
(CHEMBL2205426)
Show SMILES CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O
Show InChI InChI=1S/C23H22N6O2/c1-23(2,3)29-19-18(20(30)21(19)31)27-17-10-13-25-22(28-17)26-16-6-4-14(5-7-16)15-8-11-24-12-9-15/h4-13,29H,1-3H3,(H2,25,26,27,28)
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>8.50E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of recombinant CAMK4 after 1 hr by scintillation counter analysis in presence of gamma-[33P]ATP

Bioorg Med Chem Lett 22: 7615-22 (2012)


Article DOI: 10.1016/j.bmcl.2012.10.009
BindingDB Entry DOI: 10.7270/Q2XK8GQ3
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV


(Homo sapiens (Human))		BDBM50224883
PNG
(7-chloro-3-oxo-8-[(thiazol-5-ylmethyl)-amino]-11,1...)
Show SMILES Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NCc1cncs1)n3
Show InChI InChI=1S/C20H18ClN7O3S/c21-13-5-15-17(6-14(13)24-9-12-8-23-11-32-12)30-3-1-2-4-31-19-16(7-22)25-10-18(27-19)28-20(29)26-15/h5-6,8,10-11,24H,1-4,9H2,(H2,26,27,28,29)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of CAMK4

Bioorg Med Chem Lett 17: 6593-601 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.063
BindingDB Entry DOI: 10.7270/Q2X067WT
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223205
PNG
(6-((5-Methoxy-1H-benzo[d]imidazol-2-yl)thio)-N-(4-...)
Show SMILES COc1ccc(Nc2cc(Sc3nc4cc(OC)ccc4[nH]3)ncn2)cc1
Show InChI InChI=1S/C19H17N5O2S/c1-25-13-5-3-12(4-6-13)22-17-10-18(21-11-20-17)27-19-23-15-8-7-14(26-2)9-16(15)24-19/h3-11H,1-2H3,(H,23,24)(H,20,21,22)
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 1.01E+4n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223204
PNG
(8-((6-((5-Methoxy-1H-benzo[d]imidazol-2-yl)thio)py...)
Show SMILES COc1ccc2[nH]c(Sc3cc(Oc4cccc5cccnc45)ncn3)nc2c1
Show InChI InChI=1S/C21H15N5O2S/c1-27-14-7-8-15-16(10-14)26-21(25-15)29-19-11-18(23-12-24-19)28-17-6-2-4-13-5-3-9-22-20(13)17/h2-12H,1H3,(H,25,26)
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 2.44E+4n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type IV [15-340]


(Homo sapiens (Human))		BDBM223203
PNG
(8-((6-(Naphthalen-2-yloxy)pyrimidin-4-yl)oxy)quino...)
Show SMILES O(c1ccc2ccccc2c1)c1cc(Oc2cccc3cccnc23)ncn1
Show InChI InChI=1S/C23H15N3O2/c1-2-6-18-13-19(11-10-16(18)5-1)27-21-14-22(26-15-25-21)28-20-9-3-7-17-8-4-12-24-23(17)20/h1-15H
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 6.67E+5n/an/an/an/an/an/an/an/a



B.R. Ambedkar Bihar University



Assay Description
The docking and scoring of ligands with CAMKIV protein was accomplished using ParDOCK module of Sanjeevini drug design suite, which is based on physi...

Chem Biol Drug Des 89: 741-754 (2017)


Article DOI: 10.1111/cbdd.12898
BindingDB Entry DOI: 10.7270/Q28C9V30
More data for this
Ligand-Target Pair