General Information of the Protein
Protein ID
PT07548
Protein Name
3-hydroxy-3-methylglutaryl-coenzyme A reductase
Gene Name
HMGCR
Sequence
MLSRLFRMHGLFVASHPWEVIVGTVTLTICMMSMNMFTGNNKICGWNYECPKFEEDVLSSDIIILTITRCIAILYIYFQFQNLRQLGSKYILGIAGLFTIFSSFVFSTVVIHFLDKELTGLNEALPFFLLLIDLSRASALAKFALSSNSQDEVRENIARGMAILGPTFTLDALVECLVIGVGTMSGVRQLEIMCCFGCMSVLANYFVFMTFFPACVSLVLELSRESREGRPIWQLSHFARVLEEEENKPNPVTQRVKMIMSLGLVLVHAHSRWIADPSPQNSTTEHSKVSLGLDEDVSKRIEPSVSLWQFYLSKMISMDIEQVVTLSLAFLLAVKYIFFEQAETESTLSLKNPITSPVVTPKKAPDNCCRREPLLVRRSEKLSSVEEEPGVSQDRKVEVIKPLVVETESASRATFVLGASGTSPPVAARTQELEIELPSEPRPNEECLQILESAEKGAKFLSDAEIIQLVNAKHIPAYKLETLMETHERGVSIRRQLLSTKLPEPSSLQYLPYRDYNYSLVMGACCENVIGYMPIPVGVAGPLCLDGKEYQVPMATTEGCLVASTNRGCRAIGLGGGASSRVLADGMTRGPVVRLPRACDSAEVKAWLETPEGFAVIKDAFDSTSRFARLQKLHVTMAGRNLYIRFQSKTGDAMGMNMISKGTEKALLKLQEFFPEMQILAVSGNYCTDKKPAAINWIEGRGKTVVCEAVIPAKVVREVLKTTTEAMIDVNINKNLVGSAMAGSIGGYNAHAANIVTAIYIACGQDAAQNVGSSNCITLMEASGPTNEDLYISCTMPSIEIGTVGGGTNLLPQQACLQMLGVQGACKDNPGENARQLARIVCGTVMAGELSLMAALAAGHLVRSHMVHNRSKINLQDLQGTCTKKSA
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Organism
Cricetulus griseus, Chinese hamster, Cricetulus barabensis griseus
Protein Classification
Enzyme
>
Oxidoreductase
Function
Catalyzes the conversion of (3S)-hydroxy-3-methylglutaryl-CoA (HMG-CoA) to mevalonic acid, the rate-limiting step in the synthesis of cholesterol and other isoprenoids, thus plays a critical role in cellular cholesterol homeostasis.
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Uniprot ID
P00347
Ensembl ID
ENSG00000113161
Subcellular Location
Endoplasmic reticulum membrane
Peroxisome membrane
Map of Molecular Bioactivity Related to the Protein
Map of Molecular Bioactivity Related to the Protein

Protein
Cell Line
Compound

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Protein
Cell Line ID: CL000522 , CHO-7
 Cell Line Info 
Compound ID Compound Name Compound Formula
CP0570525
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylpentan-1-one
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C33H49N3O3
  2
1
EC50 = 130 nM
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2
EC50 = 220 nM
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CP0568279
 Compound Info 
(3R)-3-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylbutan-1-one
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C32H47N3O3
  1
1
EC50 = 280 nM
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CP0568378
 Compound Info 
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-7-ethyl-7-hydroxynonan-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol
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C32H56O3
  1
1
EC50 = 410 nM
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CP0574700
 Compound Info 
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-ethyl-6-hydroxyoctan-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol
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C31H54O3
  1
1
EC50 = 410 nM
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CP0576380
 Compound Info 
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-7-hydroxy-7-methyloctan-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol
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C30H52O3
  1
1
EC50 = 410 nM
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CP0576850
 Compound Info 
(2S)-2-[(1S,2R,13S,14S,17R,18S)-7-acetyl-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylpropan-1-one
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C31H45N3O3
  1
1
EC50 = 410 nM
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CP0578374
 Compound Info 
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-prop-2-enylnon-8-en-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol
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C33H54O3
  1
1
EC50 = 410 nM
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CP0579934
 Compound Info 
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol
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C29H50O3
  1
1
EC50 = 410 nM
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CP0576849
 Compound Info 
(4R)-N-(1-acetylpiperidin-4-yl)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentanamide
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C36H54N4O3
  1
1
EC50 = 430 nM
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CP0579788
 Compound Info 
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-prop-2-enylnon-8-en-2-yl]-4,4,10,13-tetramethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,7-diol;hydrochloride
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C33H55ClO3
  1
1
EC50 = 430 nM
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CP0579933
 Compound Info 
(4R)-1-morpholin-4-yl-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-7-(2-methylpropanoyl)-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentan-1-one
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C35H53N3O3
  1
1
EC50 = 430 nM
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CP0580241
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(oxan-4-yl)pentanamide
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C34H51N3O3
  1
1
EC50 = 480 nM
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CP0580193
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-butanoyl-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylpentan-1-one
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C35H53N3O3
  1
1
EC50 = 520 nM
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CP0577941
 Compound Info 
ethyl (1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-17-[(2R)-5-morpholin-4-yl-5-oxopentan-2-yl]-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-triene-5-carboxylate
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C34H51N3O4
  1
1
EC50 = 530 nM
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CP0568366
 Compound Info 
1-[(1S,2R,13S,14S,17R,18R)-17-[(2R)-5-ethyl-5-hydroxyheptan-2-yl]-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-7-yl]ethanone
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C33H52N2O2
  1
1
EC50 = 630 nM
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CP0576851
 Compound Info 
(4R)-1-morpholin-4-yl-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-7-propanoyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentan-1-one
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C34H51N3O3
  1
1
EC50 = 650 nM
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CP0576852
 Compound Info 
(4R)-4-[(1S,2R,12R,13S,14S,17R,18R)-12-hydroxy-2,9,9,18-tetramethyl-7-(2-methylpropanoyl)-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylpentan-1-one
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C35H53N3O4
  1
1
EC50 = 730 nM
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CP0573077
 Compound Info 
(4R)-1-morpholin-4-yl-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-7-(2-methylprop-2-enoyl)-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentan-1-one
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C35H51N3O3
  1
1
EC50 = 760 nM
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CP0568861
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-methylpentanamide
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C30H45N3O2
  1
1
EC50 = 820 nM
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CP0577333
 Compound Info 
(4R)-1-morpholin-4-yl-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-5-thia-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),6,10-trien-17-yl]pentan-1-one
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C30H45N3O2S
  1
1
EC50 = 830 nM
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CP0550510
 Compound Info 
(5R)-5-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylhexan-1-one
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C34H51N3O3
  1
1
EC50 = 980 nM
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CP0578373
 Compound Info 
(6R)-6-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylheptan-1-one
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C35H53N3O3
  1
1
EC50 = 1090 nM
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CP0580232
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-piperidin-1-ylpentan-1-one
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C34H51N3O2
  1
1
EC50 = 1260 nM
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CP0577940
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-ethylpentanamide
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C31H47N3O2
  1
1
EC50 = 1630 nM
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CP0579932
 Compound Info 
ethyl (1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-17-[(2R)-5-morpholin-4-yl-5-oxopentan-2-yl]-7-oxa-6-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-triene-5-carboxylate
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C34H50N2O5
  1
1
EC50 = 1840 nM
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CP0576848
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-propylpentanamide
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C32H49N3O2
  1
1
EC50 = 2030 nM
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CP0570171
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentanoic acid
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C29H42N2O3
  1
1
EC50 = 2660 nM
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CP0577332
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(2-morpholin-4-ylethyl)pentanamide
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C35H54N4O3
  1
1
EC50 = 2730 nM
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CP0564307
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-2,6,9,9,18-pentamethyl-7-thia-5-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentanoic acid
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C28H41NO2S
  1
1
EC50 = 3370 nM
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CP0260331
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentanoic acid
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C27H40N2O2
  1
1
EC50 = 3990 nM
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CP0550508
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(2-methylphenyl)pentanamide
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C36H49N3O2
  1
1
EC50 = 4470 nM
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CP0570524
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(5-nitro-1,3-thiazol-2-yl)pentanamide
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C32H43N5O4S
  1
1
EC50 = 4800 nM
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CP0578414
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-6-amino-2,9,9,18-tetramethyl-7-thia-5-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentanoic acid
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C27H40N2O2S
  1
1
EC50 = 4940 nM
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CP0149977
 Compound Info 
(4R)-4-[(1R,2S,5R,6R,9S,10S)-1,5,14,14-tetramethyl-16,19-diazapentacyclo[11.8.0.02,10.05,9.015,20]henicosa-12,15,17,19-tetraen-6-yl]pentanoic acid
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C28H40N2O2
  1
1
EC50 = 5020 nM
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CP0576379
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(4-methylphenyl)pentanamide
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C36H49N3O2
  1
1
EC50 = 5410 nM
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CP0577130
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-6-oxa-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4,7,10-trien-17-yl]pentanoic acid
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C26H38N2O3
  1
1
EC50 = 5810 nM
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CP0547274
 Compound Info 
(4R)-4-[(1S,2R,12R,13S,14S,17R,18R)-7-acetyl-12-hydroxy-2,9,9,18-tetramethyl-5,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-1-morpholin-4-ylpentan-1-one
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C33H49N3O4
  1
1
EC50 = 8160 nM
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CP0568377
 Compound Info 
(4R)-4-[(1R,2S,5R,6R,9S,10S)-17-amino-1,5,14,14-tetramethyl-16,18-diazapentacyclo[11.8.0.02,10.05,9.015,20]henicosa-12,15,17,19-tetraen-6-yl]-1-morpholin-4-ylpentan-1-one
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C32H48N4O2
  1
1
EC50 = 8250 nM
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CP0077533
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-2,9,9,18-tetramethyl-7-phenyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentanoic acid
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C33H44N2O2
  1
1
EC50 = 8800 nM
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CP0568376
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(5-methyl-1,3-thiazol-2-yl)pentanamide
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C33H46N4O2S
  1
1
EC50 = 12580 nM
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CP0580192
 Compound Info 
(4R)-1-morpholin-4-yl-4-[(1S,2R,13S,14S,17R,18R)-2,6,9,9,18-pentamethyl-7-oxa-5-azapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]pentan-1-one
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C32H48N2O3
  1
1
EC50 = 28080 nM
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CP0578372
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(1,3-benzothiazol-2-yl)pentanamide
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C36H46N4O2S
  1
1
EC50 = 31360 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
CP0573076
 Compound Info 
(4R)-4-[(1S,2R,13S,14S,17R,18R)-7-acetyl-2,9,9,18-tetramethyl-6,7-diazapentacyclo[11.7.0.02,10.04,8.014,18]icosa-4(8),5,10-trien-17-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)pentanamide
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C37H48N4O2S
  1
1
EC50 = 43880 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Similar Protein(s) and Bioactivity Statistics
50% Identity
Protein ID Protein Name Protein Organism
PT02011 3-hydroxy-3-methylglutaryl-coenzyme A reductase Homo sapiens, Human
 Protein Info