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7 similar compounds to monomer 50007292

Compile data set for download or QSAR
Wt: 481.5
BDBM50007306
Wt: 469.4
BDBM50007256
Wt: 519.5
BDBM50007266
Wt: 457.5
BDBM50007279
Wt: 389.4
BDBM50007280
Wt: 459.5
BDBM50007287
Wt: 386.4
BDBM50011212

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50007306,50007256,50007266,50007279,50007280,50007287,50011212   
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
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50007256
PNG
(CHEMBL420646 | Sodium; 6-{2-[bis-(4-fluoro-phenyl)...)
Show SMILES Cc1cc(C)c(OCC(O)C[C@@H](O)CC([O-])=O)c(c1)C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C27H28F2O5/c1-16-11-17(2)27(34-15-23(31)13-22(30)14-25(32)33)24(12-16)26(18-3-7-20(28)8-4-18)19-5-9-21(29)10-6-19/h3-12,22-23,26,30-31H,13-15H2,1-2H3,(H,32,33)/p-1/t22-,23?/m1/s1
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n/an/a 70n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of HMG-CoA reductase in solubilized rat liver.


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50007266
PNG
(CHEMBL100694 | Sodium; 6-{2-[(4-fluoro-phenyl)-(3-...)
Show SMILES Cc1cc(C)c(OCC(O)C[C@@H](O)CC([O-])=O)c(c1)C(c1ccc(F)cc1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C28H28F4O5/c1-16-10-17(2)27(37-15-23(34)13-22(33)14-25(35)36)24(11-16)26(18-6-8-21(29)9-7-18)19-4-3-5-20(12-19)28(30,31)32/h3-12,22-23,26,33-34H,13-15H2,1-2H3,(H,35,36)/p-1/t22-,23?,26?/m1/s1
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n/an/a 90n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of HMG-CoA reductase in solubilized rat liver.


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50007279
PNG
(CHEMBL443275 | Sodium; 6-{2-[cyclohexyl-(4-fluoro-...)
Show SMILES Cc1cc(C)c(OCC(O)C[C@@H](O)CC([O-])=O)c(c1)C(C1CCCCC1)c1ccc(F)cc1
Show InChI InChI=1S/C27H35FO5/c1-17-12-18(2)27(33-16-23(30)14-22(29)15-25(31)32)24(13-17)26(19-6-4-3-5-7-19)20-8-10-21(28)11-9-20/h8-13,19,22-23,26,29-30H,3-7,14-16H2,1-2H3,(H,31,32)/p-1/t22-,23?,26?/m1/s1
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n/an/a 95n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of HMG-CoA reductase in solubilized rat liver.


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50011212
PNG
(CHEMBL140527 | CHEMBL3349879 | Sodium; 6-(2-cycloh...)
Show SMILES [Na+].Cc1cc(C)c(OC[C@@H](O)C[C@@H](O)CC([O-])=O)c(c1)C1CCCCCC1
Show InChI InChI=1S/C21H32O5/c1-14-9-15(2)21(19(10-14)16-7-5-3-4-6-8-16)26-13-18(23)11-17(22)12-20(24)25/h9-10,16-18,22-23H,3-8,11-13H2,1-2H3,(H,24,25)/p-1/t17-,18?/m1/s1
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n/an/a 141n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Ability to inhibit microsomal preparation of HMG-CoA reductase in rat liver.


J Med Chem 34: 463-6 (1991)


Article DOI: 10.1021/jm00105a071
BindingDB Entry DOI: 10.7270/Q2MS3TC4
More data for this
Ligand-Target Pair
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50007287
PNG
(CHEMBL317726 | Sodium; 6-{2-cyclopentyl-6-[3-(4-fl...)
Show SMILES OC(COc1c(CCCOc2ccc(F)cc2)cccc1C1CCCC1)C[C@@H](O)CC([O-])=O
Show InChI InChI=1S/C26H33FO6/c27-20-10-12-23(13-11-20)32-14-4-8-19-7-3-9-24(18-5-1-2-6-18)26(19)33-17-22(29)15-21(28)16-25(30)31/h3,7,9-13,18,21-22,28-29H,1-2,4-6,8,14-17H2,(H,30,31)/p-1/t21-,22?/m1/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of HMG-CoA reductase in solubilized rat liver.


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50007306
PNG
(CHEMBL316938 | Sodium; 6-{2-[(4-fluoro-phenyl)-(4-...)
Show SMILES COc1ccc(cc1)C(c1ccc(F)cc1)c1cc(C)cc(C)c1OCC(O)C[C@@H](O)CC([O-])=O
Show InChI InChI=1S/C28H31FO6/c1-17-12-18(2)28(35-16-23(31)14-22(30)15-26(32)33)25(13-17)27(19-4-8-21(29)9-5-19)20-6-10-24(34-3)11-7-20/h4-13,22-23,27,30-31H,14-16H2,1-3H3,(H,32,33)/p-1/t22-,23?,27?/m1/s1
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n/an/a 100n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of HMG-CoA reductase in solubilized rat liver.


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50007280
PNG
(CHEMBL100560 | Sodium; 6-{2-[1-(4-fluoro-phenyl)-e...)
Show SMILES CC(c1ccc(F)cc1)c1cc(C)cc(C)c1OCC(O)C[C@@H](O)CC([O-])=O
Show InChI InChI=1S/C22H27FO5/c1-13-8-14(2)22(28-12-19(25)10-18(24)11-21(26)27)20(9-13)15(3)16-4-6-17(23)7-5-16/h4-9,15,18-19,24-25H,10-12H2,1-3H3,(H,26,27)/p-1/t15?,18-,19?/m1/s1
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n/an/a 160n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibition of HMG-CoA reductase in solubilized rat liver.


J Med Chem 34: 2962-83 (1991)


Article DOI: 10.1021/jm00114a004
BindingDB Entry DOI: 10.7270/Q2C829WX
More data for this
Ligand-Target Pair