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Compile Data Set for Download or QSAR

Found 30 hits of ic50 data for polymerid = 1070   
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
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM2579
PNG
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)
Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Show InChI InChI=1/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/s2
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n/an/a 66n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50267481
PNG
(6-tert-Butyl-4-{[(4-hydroxy-5-propoxy-pyridin-2-yl...)
Show SMILES CCCOc1cnc(CNC=C2C(=O)NC(=O)c3ccc(cc23)C(C)(C)C)cc1O
Show InChI InChI=1S/C23H27N3O4/c1-5-8-30-20-13-25-15(10-19(20)27)11-24-12-18-17-9-14(23(2,3)4)6-7-16(17)21(28)26-22(18)29/h6-7,9-10,12-13,24H,5,8,11H2,1-4H3,(H,25,27)(H,26,28,29)/b18-12-
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n/an/a 200n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma susceptibility gene product phosphorylation in human MCF7 cells after 24 hrs


J Med Chem 52: 2289-310 (2009)


Article DOI: 10.1021/jm801026e
BindingDB Entry DOI: 10.7270/Q27H1JG7
More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50267581
PNG
((4Z)-4-[({[1-(3-Furyl)-2-oxo-1,2-dihydropyridin-4-...)
Show SMILES Ic1ccc2C(=O)NC(=O)C(=CNCc3ccn(-c4ccoc4)c(=O)c3)c2c1
Show InChI InChI=1S/C20H14IN3O4/c21-13-1-2-15-16(8-13)17(20(27)23-19(15)26)10-22-9-12-3-5-24(18(25)7-12)14-4-6-28-11-14/h1-8,10-11,22H,9H2,(H,23,26,27)/b17-10-
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n/an/a 370n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma susceptibility gene product phosphorylation in human MCF7 cells after 24 hrs


J Med Chem 52: 2289-310 (2009)


Article DOI: 10.1021/jm801026e
BindingDB Entry DOI: 10.7270/Q27H1JG7
More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50267255
PNG
(4-[(4-Furan-3-yl-3-hydroxy-benzylamino)-methylene]...)
Show SMILES Oc1cc(CNC=C2C(=O)NC(=O)c3ccc(I)cc23)ccc1-c1ccoc1
Show InChI InChI=1S/C21H15IN2O4/c22-14-2-4-16-17(8-14)18(21(27)24-20(16)26)10-23-9-12-1-3-15(19(25)7-12)13-5-6-28-11-13/h1-8,10-11,23,25H,9H2,(H,24,26,27)/b18-10-
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n/an/a 610n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma susceptibility gene product phosphorylation in human MCF7 cells after 24 hrs


J Med Chem 52: 2289-310 (2009)


Article DOI: 10.1021/jm801026e
BindingDB Entry DOI: 10.7270/Q27H1JG7
More data for this
Ligand-Target Pair
Retinoblastoma-associated protein


(Homo sapiens (Human))
BDBM50251835
PNG
(CHEMBL4092194)
Show SMILES CC1CCC(C1)NC1CCc2c(C1)[nH]c1ccc(C)cc21
Show InChI InChI=1/C19H26N2/c1-12-3-5-14(9-12)20-15-6-7-16-17-10-13(2)4-8-18(17)21-19(16)11-15/h4,8,10,12,14-15,20-21H,3,5-7,9,11H2,1-2H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of FITC-Bak-BH3 binding to recombinant MBP-fused MCL1 (172 to 318 residues) (unknown origin) in presence of BSA by TR-FRET assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251836
PNG
(CHEMBL4070561)
Show SMILES Cl.Cc1ccc2[nH]c3CC(CCc3c2c1)NCc1ccccc1
Show InChI InChI=1/C20H22N2.ClH/c1-14-7-10-19-18(11-14)17-9-8-16(12-20(17)22-19)21-13-15-5-3-2-4-6-15;/h2-7,10-11,16,21-22H,8-9,12-13H2,1H3;1H
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n/an/a 2.20E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251866
PNG
(CHEMBL4070208)
Show SMILES Cl.Cc1ccc(CNC2CCc3c(C2)[nH]c2ccc(C)cc32)cc1
Show InChI InChI=1/C21H24N2.ClH/c1-14-3-6-16(7-4-14)13-22-17-8-9-18-19-11-15(2)5-10-20(19)23-21(18)12-17;/h3-7,10-11,17,22-23H,8-9,12-13H2,1-2H3;1H
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n/an/a 2.90E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251841
PNG
(CHEMBL4068198)
Show SMILES Cc1ccc(CNC2CCc3c(C2)n(C)c2ccccc32)cc1
Show InChI InChI=1/C21H24N2/c1-15-7-9-16(10-8-15)14-22-17-11-12-19-18-5-3-4-6-20(18)23(2)21(19)13-17/h3-10,17,22H,11-14H2,1-2H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251835
PNG
(CHEMBL4092194)
Show SMILES CC1CCC(C1)NC1CCc2c(C1)[nH]c1ccc(C)cc21
Show InChI InChI=1/C19H26N2/c1-12-3-5-14(9-12)20-15-6-7-16-17-10-13(2)4-8-18(17)21-19(16)11-15/h4,8,10,12,14-15,20-21H,3,5-7,9,11H2,1-2H3
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n/an/a 3.60E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251850
PNG
(CHEMBL4077816)
Show SMILES Cc1ccc(CNC2CCc3c(C2)[nH]c2ccccc32)cc1
Show InChI InChI=1/C20H22N2/c1-14-6-8-15(9-7-14)13-21-16-10-11-18-17-4-2-3-5-19(17)22-20(18)12-16/h2-9,16,21-22H,10-13H2,1H3
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n/an/a 4.10E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251837
PNG
(CHEMBL4068744)
Show SMILES CC1CCC(C1)NC1CCCc2c1[nH]c1ccc(cc21)[N+]([O-])=O
Show InChI InChI=1/C18H23N3O2/c1-11-5-6-12(9-11)19-17-4-2-3-14-15-10-13(21(22)23)7-8-16(15)20-18(14)17/h7-8,10-12,17,19-20H,2-6,9H2,1H3
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n/an/a 4.81E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251834
PNG
(CHEMBL4061653)
Show SMILES C(NC1CCc2c(C1)[nH]c1ccccc21)c1ccccc1
Show InChI InChI=1/C19H20N2/c1-2-6-14(7-3-1)13-20-15-10-11-17-16-8-4-5-9-18(16)21-19(17)12-15/h1-9,15,20-21H,10-13H2
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n/an/a 6.92E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251768
PNG
(CHEMBL4065808)
Show SMILES CC1CCC(C1)NC1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1/C18H24N2/c1-12-9-10-13(11-12)19-17-8-4-6-15-14-5-2-3-7-16(14)20-18(15)17/h2-3,5,7,12-13,17,19-20H,4,6,8-11H2,1H3
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n/an/a 9.00E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251779
PNG
(CHEMBL4076325)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1/C18H17FN2O2S/c19-12-8-10-13(11-9-12)24(22,23)21-17-7-3-5-15-14-4-1-2-6-16(14)20-18(15)17/h1-2,4,6,8-11,17,20-21H,3,5,7H2
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n/an/a 9.20E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251809
PNG
(CHEMBL4075949)
Show SMILES Fc1ccc(cc1)S(=O)(=O)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C18H17FN2O2S/c19-12-5-8-14(9-6-12)24(22,23)21-13-7-10-16-15-3-1-2-4-17(15)20-18(16)11-13/h1-6,8-9,13,20-21H,7,10-11H2
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n/an/a 9.50E+3n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251781
PNG
(CHEMBL4075814)
Show SMILES C1CCC(C1)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C17H22N2/c1-2-6-12(5-1)18-13-9-10-15-14-7-3-4-8-16(14)19-17(15)11-13/h3-4,7-8,12-13,18-19H,1-2,5-6,9-11H2
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n/an/a 1.00E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Retinoblastoma-associated protein


(Homo sapiens (Human))
BDBM50251767
PNG
(CHEMBL4092469)
Show SMILES C1CCC(C1)NC1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1/C17H22N2/c1-2-7-12(6-1)18-16-11-5-9-14-13-8-3-4-10-15(13)19-17(14)16/h3-4,8,10,12,16,18-19H,1-2,5-7,9,11H2
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n/an/a 1.00E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of FITC-Bak-BH3 binding to recombinant MBP-fused MCL1 (172 to 318 residues) (unknown origin) in presence of 1% FBS by TR-FRET assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251843
PNG
(CHEMBL4064772)
Show SMILES C1CCC(CC1)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C18H24N2/c1-2-6-13(7-3-1)19-14-10-11-16-15-8-4-5-9-17(15)20-18(16)12-14/h4-5,8-9,13-14,19-20H,1-3,6-7,10-12H2
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n/an/a 1.10E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Retinoblastoma-associated protein


(Homo sapiens (Human))
BDBM50251768
PNG
(CHEMBL4065808)
Show SMILES CC1CCC(C1)NC1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1/C18H24N2/c1-12-9-10-13(11-12)19-17-8-4-6-15-14-5-2-3-7-16(14)20-18(15)17/h2-3,5,7,12-13,17,19-20H,4,6,8-11H2,1H3
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n/an/a 1.50E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251761
PNG
(CHEMBL4071674)
Show SMILES Cl.C1CCC(CC1)NC1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1/C18H24N2.ClH/c1-2-7-13(8-3-1)19-17-12-6-10-15-14-9-4-5-11-16(14)20-18(15)17;/h4-5,9,11,13,17,19-20H,1-3,6-8,10,12H2;1H
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n/an/a 1.50E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251767
PNG
(CHEMBL4092469)
Show SMILES C1CCC(C1)NC1CCCc2c1[nH]c1ccccc21
Show InChI InChI=1/C17H22N2/c1-2-7-12(6-1)18-16-11-5-9-14-13-8-3-4-10-15(13)19-17(14)16/h3-4,8,10,12,16,18-19H,1-2,5-7,9,11H2
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n/an/a 1.60E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251806
PNG
(CHEMBL4088842)
Show SMILES Cl.CC1CCC(C1)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C18H24N2.ClH/c1-12-6-7-13(10-12)19-14-8-9-16-15-4-2-3-5-17(15)20-18(16)11-14;/h2-5,12-14,19-20H,6-11H2,1H3;1H
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n/an/a 1.73E+4n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251849
PNG
(CHEMBL4060594)
Show SMILES Fc1cccc(c1)C(=O)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C19H17FN2O/c20-13-5-3-4-12(10-13)19(23)21-14-8-9-16-15-6-1-2-7-17(15)22-18(16)11-14/h1-7,10,14,22H,8-9,11H2,(H,21,23)
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n/an/a 1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251780
PNG
(CHEMBL4094137)
Show SMILES O=S(=O)(NC1CCCc2c1[nH]c1ccccc21)c1ccc(cc1)C#N
Show InChI InChI=1/C19H17N3O2S/c20-12-13-8-10-14(11-9-13)25(23,24)22-18-7-3-5-16-15-4-1-2-6-17(15)21-19(16)18/h1-2,4,6,8-11,18,21-22H,3,5,7H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251816
PNG
(CHEMBL4082197)
Show SMILES Fc1ccccc1C(=O)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C19H17FN2O/c20-16-7-3-1-6-15(16)19(23)21-12-9-10-14-13-5-2-4-8-17(13)22-18(14)11-12/h1-8,12,22H,9-11H2,(H,21,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251842
PNG
(CHEMBL4082537)
Show SMILES O=S(=O)(NC1CCCc2c1[nH]c1ccccc21)c1cccnc1
Show InChI InChI=1/C17H17N3O2S/c21-23(22,12-5-4-10-18-11-12)20-16-9-3-7-14-13-6-1-2-8-15(13)19-17(14)16/h1-2,4-6,8,10-11,16,19-20H,3,7,9H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251808
PNG
(CHEMBL4067615)
Show SMILES Cl.C1CC(CCO1)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C17H22N2O.ClH/c1-2-4-16-14(3-1)15-6-5-13(11-17(15)19-16)18-12-7-9-20-10-8-12;/h1-4,12-13,18-19H,5-11H2;1H
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251814
PNG
(CHEMBL4083343)
Show SMILES O=S(=O)(NC1CCc2c(C1)[nH]c1ccccc21)c1ccc(cc1)C#N
Show InChI InChI=1/C19H17N3O2S/c20-12-13-5-8-15(9-6-13)25(23,24)22-14-7-10-17-16-3-1-2-4-18(16)21-19(17)11-14/h1-6,8-9,14,21-22H,7,10-11H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251815
PNG
(CHEMBL4077480)
Show SMILES COc1cccc(c1)C(=O)NC1CCc2c(C1)[nH]c1ccccc21
Show InChI InChI=1/C20H20N2O2/c1-24-15-6-4-5-13(11-15)20(23)21-14-9-10-17-16-7-2-3-8-18(16)22-19(17)12-14/h2-8,11,14,22H,9-10,12H2,1H3,(H,21,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair
Histidine-tagged Rb


(Homo sapiens (Human))
BDBM50251848
PNG
(CHEMBL4063962)
Show SMILES O=S(=O)(NC1CCc2c(C1)[nH]c1ccccc21)c1cccnc1
Show InChI InChI=1/C17H17N3O2S/c21-23(22,13-4-3-9-18-11-13)20-12-7-8-15-14-5-1-2-6-16(14)19-17(15)10-12/h1-6,9,11-12,19-20H,7-8,10H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Padmashri Vikhe Patil College of Arts

Curated by ChEMBL


Assay Description
Inhibition of retinoblastoma protein phosphorylation in human MDA-MB-231 cells after 16 hrs by Hoechst 33342 staining based fluorescence assay


Eur J Med Chem 134: 366-378 (2017)

More data for this
Ligand-Target Pair