Compound ID |
Compound Name |
Compound Formula |
CP0182760
|
Sarsasapogenin
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|
C27H44O3
|
2
|
1 |
IC50 = 104.71 nM
|
|
|
2 |
Ki = 80 nM
|
|
|
CP0052039
|
18beta-glycyrrhetic acid
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|
C30H46O4
|
2
|
1 |
IC50 = 549.54 nM
|
|
|
2 |
Ki = 420 nM
|
|
|
CP0166263
|
NORSTICTIC ACID
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|
C18H12O9
|
2
|
1 |
IC50 = 549.54 nM
|
|
|
2 |
Ki = 420 nM
|
|
|
CP0870363
|
BUSSEIN
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|
C43H54O18
|
2
|
1 |
IC50 = 691.83 nM
|
|
|
2 |
Ki = 530 nM
|
|
|
CP0423174
|
[(1R,3Z,6S,7R,9R,10R,15R,16S,19S,20S)-18-acetyloxy-6-(furan-3-yl)-9,19,20-trimethoxy-3-(1-methoxy-2-methylpropylidene)-16-(2-methoxy-2-oxoethyl)-7,12,15,17-tetramethyl-4-oxo-5,11,13,21-tetraoxaheptacyclo[10.8.1.114,17.01,10.02,7.010,15.014,19]docosan-8-yl] 2-methylpropanoate
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|
C43H58O16
|
2
|
1 |
IC50 = 724.44 nM
|
|
|
2 |
Ki = 560 nM
|
|
|
CP0051629
|
4-hydroxy-3-(4-hydroxyphenyl)-5-methoxy-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-2-one
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|
C26H26O6
|
2
|
1 |
IC50 = 741.31 nM
|
|
|
2 |
Ki = 560 nM
|
|
|
CP0077816
|
LASALOCID A SODIUM
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|
C34H53NaO8
|
2
|
1 |
IC50 = 776.25 nM
|
|
|
2 |
Ki = 590 nM
|
|
|
CP0391465
|
[(1R,2R,7S,8R,9S,17S,18S,20R,22S)-8-acetyloxy-17-(furan-3-yl)-3,7-dihydroxy-22-(2-methoxy-2-oxoethyl)-2,5,11,18-tetramethyl-20-(2-methylbutanoyloxy)-15-oxo-10,12,16,21-tetraoxaheptacyclo[9.9.1.12,5.01,9.03,7.09,13.013,18]docosan-6-yl] 2,3-dimethyloxirane-2-carboxylate
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|
C41H52O17
|
2
|
1 |
IC50 = 776.25 nM
|
|
|
2 |
Ki = 600 nM
|
|
|
CP0272224
|
4-Epi-Hederagenin
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|
C30H48O4
|
2
|
1 |
IC50 = 891.25 nM
|
|
|
2 |
Ki = 680 nM
|
|
|
CP0071410
|
Benicar
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|
C29H30N6O6
|
2
|
1 |
IC50 = 977.24 nM
|
|
|
2 |
Ki = 750 nM
|
|
|
CP0018902
|
(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid
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|
C20H32O2
|
2
|
1 |
IC50 = 1071.52 nM
|
|
|
2 |
Ki = 820 nM
|
|
|
CP0043276
|
CAS_114798-26-4
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|
C22H23ClN6O
|
2
|
1 |
IC50 = 1148.15 nM
|
|
|
2 |
Ki = 890 nM
|
|
|
CP0370401
|
(9beta,10alpha,11alpha,14beta,16alpha,17alpha)-9,21-dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate
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|
C27H30Cl2O6
|
2
|
1 |
IC50 = 1148.15 nM
|
|
|
2 |
Ki = 870 nM
|
|
|
CP0650250
|
SID855631
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|
C44H43ClN2O8
|
2
|
1 |
IC50 = 1230.27 nM
|
|
|
2 |
Ki = 940 nM
|
|
|
CP0083167
|
4'-((1,4'-dimethyl-2'-propyl(2,6'-bi-1H-benzimidazol)-1'-yl)methyl)-(1,1'-biphenyl)-2-carboxylic acid
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|
C33H30N4O2
|
2
|
1 |
IC50 = 1258.93 nM
|
|
|
2 |
Ki = 960 nM
|
|
|
CP0433032
|
[(1S,4bS,5R,6aS,8R,10aR,10bS,12aS)-5-acetyloxy-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-8-yl] acetate
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|
C30H40O7
|
2
|
1 |
IC50 = 1412.54 nM
|
|
|
2 |
Ki = 1080 nM
|
|
|
CP0027182
|
3-hydroxy-9-methoxy-6-oxo-7-pentanoyl-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid
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|
C25H28O8
|
2
|
1 |
IC50 = 1621.81 nM
|
|
|
2 |
Ki = 1250 nM
|
|
|
CP0408703
|
CARBENOXOLONE DISODIUM
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|
C34H48Na2O7
|
2
|
1 |
IC50 = 1905.46 nM
|
|
|
2 |
Ki = 1480 nM
|
|
|
CP0379894
|
BRL-1702
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|
C19H18Cl2N3NaO6S
|
2
|
1 |
IC50 = 1995.26 nM
|
|
|
2 |
Ki = 1550 nM
|
|
|
CP0391187
|
ERYTHROMYCIN ETHYLSUCCINATE
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|
C43H75NO16
|
2
|
1 |
IC50 = 2089.3 nM
|
|
|
2 |
Ki = 1610 nM
|
|
|
CP0391198
|
(4R)-4-[(E)-3-carboxybut-2-enyl]-14-hydroxy-6,6,18-trimethyl-21-(3-methylbut-2-enyl)-18-(4-methylpent-3-enyl)-12-oxo-2,5,19-trioxapentacyclo[11.8.0.03,7.03,11.015,20]henicosa-1(13),10,14,16,20-pentaene-4-carboxylic acid
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|
C38H46O9
|
2
|
1 |
IC50 = 2238.72 nM
|
|
|
2 |
Ki = 1730 nM
|
|
|
CP0283462
|
4-[12,18-dihydroxy-8,21,21-trimethyl-5-(3-methylbutyl)-8-(4-methylpentyl)-14-oxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11-tetraen-19-yl]-2-methylbutanoic acid
Show/Hide
|
C38H54O8
|
2
|
1 |
IC50 = 2290.87 nM
|
|
|
2 |
Ki = 1770 nM
|
|
|
CP0083586
|
methyl 8,10-dichloro-3,9-dihydroxy-1,4,7-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylate
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|
C18H14Cl2O7
|
2
|
1 |
IC50 = 2398.83 nM
|
|
|
2 |
Ki = 1840 nM
|
|
|
CP0024953
|
2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid 1-cyclohexyloxycarbonyloxy-ethyl ester
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|
C33H34N6O6
|
2
|
1 |
IC50 = 2454.71 nM
|
|
|
2 |
Ki = 1900 nM
|
|
|
CP0161979
|
methyl 8,10-dichloro-9-hydroxy-3-methoxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylate
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|
C18H14Cl2O7
|
2
|
1 |
IC50 = 2630.27 nM
|
|
|
2 |
Ki = 2020 nM
|
|
|
CP0381174
|
(Z)-4-[(1S,2S,8R,17S,19S)-12,18-dihydroxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14-oxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11-tetraen-19-yl]-2-methylbut-2-enoic acid
Show/Hide
|
C38H48O8
|
2
|
1 |
IC50 = 2818.38 nM
|
|
|
2 |
Ki = 2160 nM
|
|
|
CP0280690
|
(Z)-4-[12,18-dihydroxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14-oxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
Show/Hide
|
C38H46O8
|
2
|
1 |
IC50 = 2884.03 nM
|
|
|
2 |
Ki = 2240 nM
|
|
|
CP0355438
|
BETA CAROTENE
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|
C40H56
|
2
|
1 |
IC50 = 2951.21 nM
|
|
|
2 |
Ki = 2260 nM
|
|
|
CP0381198
|
[(1R,2R,4S,7R,8R,11R,12S,13S,15R,17S,19R)-13-acetyloxy-7-(furan-3-yl)-19-hydroxy-1,8,12,16,16-pentamethyl-5-oxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadecan-15-yl] acetate
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|
C30H40O9
|
2
|
1 |
IC50 = 2951.21 nM
|
|
|
2 |
Ki = 2270 nM
|
|
|
CP0426731
|
(1S,2R,4S,7S,8S,11R,12R,13R,15R,18R,20R)-7-(furan-3-yl)-20-hydroxy-1,8,12,17,17-pentamethyl-3,6,14-trioxahexacyclo[9.9.0.02,4.02,8.012,18.013,15]icosane-5,16-dione
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|
C26H32O7
|
1
|
1 |
IC50 = 2951.21 nM
|
|
|
CP0423162
|
Erythromycin Estolate
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|
C52H97NO18S
|
2
|
1 |
IC50 = 3090.3 nM
|
|
|
2 |
Ki = 2350 nM
|
|
|
CP0391194
|
beta-DIHYDROGEDUNOL
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|
C28H38O7
|
1
|
1 |
IC50 = 3235.94 nM
|
|
|
CP0133264
|
A-56268
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|
C38H69NO13
|
1
|
1 |
IC50 = 3311.31 nM
|
|
|
CP0429602
|
(1S,4bS,5R,6aS,10aS,10bS,12aS)-1-(furan-3-yl)-5-hydroxy-4b,7,7,10a,12a-pentamethyl-5,6,6a,9,10,10b,11,12-octahydro-1H-naphtho[2,1-f]isochromene-3,8-dione
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|
C26H34O5
|
2
|
1 |
IC50 = 3311.31 nM
|
|
|
2 |
Ki = 2550 nM
|
|
|
CP0113897
|
BILIRUBIN
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|
C33H36N4O6
|
2
|
1 |
IC50 = 3388.44 nM
|
|
|
2 |
Ki = 2630 nM
|
|
|
CP0198648
|
Beta-Escin
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|
C54H84O24
|
2
|
1 |
IC50 = 3388.44 nM
|
|
|
2 |
Ki = 2610 nM
|
|
|
CP0391202
|
PRIEURIANIN
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|
C37H48O16
|
2
|
1 |
IC50 = 3388.44 nM
|
|
|
2 |
Ki = 2630 nM
|
|
|
CP0391204
|
Atorvastatin
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|
C66H68CaF2N4O10
|
2
|
1 |
IC50 = 3388.44 nM
|
|
|
2 |
Ki = 2580 nM
|
|
|
CP0877478
|
ANTHOTHECOL
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|
C28H32O7
|
2
|
1 |
IC50 = 3467.37 nM
|
|
|
2 |
Ki = 2640 nM
|
|
|
CP0059405
|
CHOLIC ACID, METHYL ESTER
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|
C25H42O5
|
2
|
1 |
IC50 = 3715.35 nM
|
|
|
2 |
Ki = 2890 nM
|
|
|
CP0109019
|
Conceptrol
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|
C33H60O10
|
2
|
1 |
IC50 = 3715.35 nM
|
|
|
2 |
Ki = 2870 nM
|
|
|
CP0381175
|
[(1S,4bS,5R,6aS,8R,10aR,10bS,12aS)-1-(furan-3-yl)-8-hydroxy-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,10b,11,12-octahydronaphtho[2,1-f]isochromen-5-yl] acetate
Show/Hide
|
C28H36O6
|
2
|
1 |
IC50 = 3715.35 nM
|
|
|
2 |
Ki = 2890 nM
|
|
|
CP0433071
|
METHYL 6-ACETOXYANGOLENSATE
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|
C29H36O9
|
2
|
1 |
IC50 = 3801.89 nM
|
|
|
2 |
Ki = 2920 nM
|
|
|
CP0435006
|
[(1S,4bS,5R,6aS,10aS,10bS,12aS)-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-5,6,6a,10b,11,12-hexahydro-1H-naphtho[2,1-f]isochromen-5-yl] acetate
Show/Hide
|
C28H34O6
|
2
|
1 |
IC50 = 3801.89 nM
|
|
|
2 |
Ki = 2890 nM
|
|
|
CP0012708
|
5,7-dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one
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|
C15H10O5
|
2
|
1 |
IC50 = 3890.45 nM
|
|
|
2 |
Ki = 2960 nM
|
|
|
CP0514201
|
[(1S,2R,4S,7S,8S,10R,11R,12S,13S,15R,17S,19R)-10,13,15-triacetyloxy-7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5-oxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadecan-19-yl] acetate
Show/Hide
|
C34H44O12
|
2
|
1 |
IC50 = 3981.07 nM
|
|
|
2 |
Ki = 3050 nM
|
|
|
CP0042741
|
AURIN
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|
C19H14O3
|
2
|
1 |
IC50 = 4073.8 nM
|
|
|
2 |
Ki = 3150 nM
|
|
|
CP0070921
|
MLS001335996
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|
C76H52O46
|
2
|
1 |
IC50 = 4168.69 nM
|
|
|
2 |
Ki = 3230 nM
|
|
|
CP0645768
|
SID855643
Show/Hide
|
C25H22O10
|
2
|
1 |
IC50 = 4265.8 nM
|
|
|
2 |
Ki = 3270 nM
|
|
|
CP0074965
|
(-)-Epicatechin-3-gallate
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|
C22H18O10
|
2
|
1 |
IC50 = 4466.84 nM
|
|
|
2 |
Ki = 3460 nM
|
|
|
CP0388301
|
[(2R,3R)-2-[1-[(2R,3R)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-3,4-dihydro-2H-chromen-2-yl]-3,4,6-trihydroxy-5-oxobenzo[7]annulen-8-yl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
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|
C43H32O20
|
2
|
1 |
IC50 = 4466.84 nM
|
|
|
2 |
Ki = 3420 nM
|
|
|
CP0391201
|
methyl 2-[(1S,3S,5S,7S,8S,9R,12S,13S)-5-acetyloxy-13-(furan-3-yl)-6,6,8,12-tetramethyl-17-methylidene-15-oxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate
Show/Hide
|
C29H38O8
|
2
|
1 |
IC50 = 4466.84 nM
|
|
|
2 |
Ki = 3470 nM
|
|
|
CP0038508
|
7-[8-formyl-1,6,7-trihydroxy-3-methyl-5-(propan-2-yl)naphthalen-2-yl]-2,3,8-trihydroxy-6-methyl-4-(propan-2-yl)naphthalene-1-carbaldehyde
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|
C30H30O8
|
2
|
1 |
IC50 = 4570.88 nM
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|
|
2 |
Ki = 3470 nM
|
|
|
CP0049972
|
RETINYL ACETATE
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|
C22H32O2
|
2
|
1 |
IC50 = 5011.87 nM
|
|
|
2 |
Ki = 3890 nM
|
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|
CP0381172
|
(1R,2R,4S,7S,8S,11R,12S,15S,17R)-7-(furan-3-yl)-15-hydroxy-1,8,12,16,16-pentamethyl-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-ene-5,19-dione
Show/Hide
|
C26H32O6
|
2
|
1 |
IC50 = 5011.87 nM
|
|
|
2 |
Ki = 3810 nM
|
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|
CP0066372
|
methyl (Z)-4-[12-methoxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4,6(11),9,12,15-pentaen-19-yl]-2-methylbut-2-enoate
Show/Hide
|
C40H48O8
|
2
|
1 |
IC50 = 5128.61 nM
|
|
|
2 |
Ki = 3940 nM
|
|
|
CP0137277
|
Abietic Acid
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|
C20H30O2
|
2
|
1 |
IC50 = 5248.07 nM
|
|
|
2 |
Ki = 4080 nM
|
|
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CP0433070
|
[(2R,3R,4S,5R)-3-[(2R,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aR,5R,6aR,6aS,6bR,8aR,10S,12aR,14bR)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
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|
C58H94O25
|
2
|
1 |
IC50 = 5248.07 nM
|
|
|
2 |
Ki = 4020 nM
|
|
|
CP0433021
|
Acetyl Isogambogic Acid
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|
C40H46O9
|
2
|
1 |
IC50 = 5370.32 nM
|
|
|
2 |
Ki = 4170 nM
|
|
|
CP0019370
|
Ketek
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|
C43H65N5O10
|
1
|
1 |
IC50 = 5888.44 nM
|
|
|
CP0014077
|
2,2-Dimethyl-5-(2,5-dimethylphenoxy)valeriansaeure
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|
C15H22O3
|
1
|
1 |
IC50 = 7079.46 nM
|
|
|
CP0423173
|
[(1R,4bR,5R,6aR,10aR,10bR,12aR)-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-5,6,6a,9,10,10b,11,12-octahydro-1H-naphtho[2,1-f]isochromen-5-yl] acetate
Show/Hide
|
C28H36O6
|
2
|
1 |
IC50 = 7762.47 nM
|
|
|
2 |
Ki = 5990 nM
|
|
|
CP0461909
|
[(2R,3R)-5,7-dihydroxy-2-[3,4,5-trihydroxy-2-[2,3,4-trihydroxy-6-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]phenyl]phenyl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
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|
C37H30O18
|
2
|
1 |
IC50 = 8511.38 nM
|
|
|
2 |
Ki = 6500 nM
|
|
|
CP0040077
|
(3beta)-3-hydroxyurs-12-en-28-oic acid
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|
C30H48O3
|
1
|
1 |
IC50 = 11481.54 nM
|
|
|
CP0423164
|
3-acetyl-11-keto-ursolic acid
Show/Hide
|
C32H48O5
|
1
|
1 |
IC50 = 11481.54 nM
|
|
|
CP0054979
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DIGOXIN
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C41H64O14
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1
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1 |
IC50 = 13182.57 nM
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CP0423160
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Oligomycin
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C45H74O11
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1
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1 |
Ki = 440 nM
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CP0385369
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[(1S,4bS,5R,8S,10aR,12aS)-5-acetyloxy-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-8-yl] acetate
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C30H40O7
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1
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1 |
Ki = 2670 nM
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CP0433020
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Lorglumide Sodium
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C22H31Cl2N2NaO4
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1
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1 |
Ki = 2710 nM
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CP0432848
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methyl 2-[(1S,3S,5S,7S,8S,9R,12S,13S)-13-(furan-3-yl)-5-hydroxy-6,6,8,12-tetramethyl-17-methylidene-15-oxo-2,14-dioxatetracyclo[7.7.1.01,12.03,8]heptadecan-7-yl]acetate
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C27H36O7
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1
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1 |
Ki = 3060 nM
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CP0433031
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Salinomycin Sodium
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C42H69NaO11
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1
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1 |
Ki = 3310 nM
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CP0021823
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(2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl 3-methylbutanoate
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C28H40N2O9
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1
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1 |
Ki = 3820 nM
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CP0391197
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[(1S,4bS,5R,8R,10S,10aR,12aR)-1-(furan-3-yl)-8,10-dihydroxy-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-5-yl] acetate
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C28H38O7
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1
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1 |
Ki = 6590 nM
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