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Compile Data Set for Download or QSAR

Found 7 hits with Last Name = 'ahamad' and Initial = 's'   
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
Calcium/calmodulin- dependent protein kinase IV (CAMKIV)


(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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PC cid
PC sid
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 IV (CAMKIV)


(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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PC sid
UniChem
Article
PubMed
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 IV (CAMKIV)


(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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UniChem
Article
PubMed
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 IV (CAMKIV)


(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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PC sid
UniChem
Article
PubMed
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 IV (CAMKIV)


(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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PC sid
UniChem
Article
PubMed
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 IV (CAMKIV)


(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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PC sid
UniChem
Article
PubMed
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 IV (CAMKIV)


(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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UniChem
Article
PubMed
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