Compound ID |
Compound Name |
Compound Formula |
CP0964645
|
(2S,5S,8S,14S,32S,35R,38S,46E,50S,54S)-54-[(5-fluoro-1H-indol-3-yl)methyl]-5-[(1R)-1-methoxyethyl]-8-[(4-methoxyphenyl)methyl]-14,32,35-trimethyl-49-oxa-19,27-dithia-1,4,7,10,16,31,34,37,55-nonazahexacyclo[36.14.4.121,25.140,44.02,50.010,14]octapentaconta-21,23,25(58),40,42,44(57),46-heptaene-3,6,9,15,30,33,36,53,56-nonone
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C69H85FN10O12S2
|
1
|
1 |
EC50 = 130 nM
|
|
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CP0577981
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(1S,9E,13S,17S,20S,23S,29S,55S,60R,63S)-63-(aminomethyl)-50-fluoro-20-[(1R)-1-hydroxyethyl]-23-[(4-methoxyphenyl)methyl]-29,60-dimethyl-12-oxa-34,68-dithia-16,19,22,25,31,41,42,43,46,56,58,61,64-tridecazadecacyclo[36.19.12.13,7.116,55.136,40.141,44.146,53.013,17.025,29.047,52]tetraheptaconta-3,5,7(74),9,36(73),37,39,42,44(72),47(52),48,50,53(71)-tridecaene-18,21,24,30,57,59,62,65,70-nonone
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C71H85FN14O12S2
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1
|
1 |
EC50 = 600 nM
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|
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CP0543806
|
2-[2-[3-[[(1S,9E,13S,17S,20S,23S,29S,55S,60R,63S)-50-fluoro-20-[(1R)-1-hydroxyethyl]-23-[(4-methoxyphenyl)methyl]-29,63-dimethyl-18,21,24,30,57,59,62,65,70-nonaoxo-12-oxa-34,68-dithia-16,19,22,25,31,41,42,43,46,56,58,61,64-tridecazadecacyclo[36.19.12.13,7.116,55.136,40.141,44.146,53.013,17.025,29.047,52]tetraheptaconta-3,5,7(74),9,36(73),37,39,42,44(72),47(52),48,50,53(71)-tridecaen-60-yl]methylamino]-3-oxopropoxy]ethoxy]ethyl-trimethylazanium
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C81H105FN15O15S2+
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1
|
1 |
EC50 = 2500 nM
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|
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CP0573928
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3-[2-(2-aminoethoxy)ethoxy]-N-[[(1S,9E,13S,17S,20S,23S,29S,55S,60R,63S)-50-fluoro-20-[(1R)-1-hydroxyethyl]-23-[(4-methoxyphenyl)methyl]-29,60-dimethyl-18,21,24,30,57,59,62,65,70-nonaoxo-12-oxa-34,68-dithia-16,19,22,25,31,41,42,43,46,56,58,61,64-tridecazadecacyclo[36.19.12.13,7.116,55.136,40.141,44.146,53.013,17.025,29.047,52]tetraheptaconta-3,5,7(74),9,36(73),37,39,42,44(72),47(52),48,50,53(71)-tridecaen-63-yl]methyl]propanamide
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C78H98FN15O15S2
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1
|
1 |
EC50 = 6000 nM
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|
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CP0354520
|
2-[2-[3-[[(1S,9E,13S,17S,20S,23S,29S,55S,60R,63S)-50-fluoro-20-[(1R)-1-hydroxyethyl]-23-[(4-methoxyphenyl)methyl]-29,60-dimethyl-18,21,24,30,57,59,62,65,70-nonaoxo-12-oxa-34,68-dithia-16,19,22,25,31,41,42,43,46,56,58,61,64-tridecazadecacyclo[36.19.12.13,7.116,55.136,40.141,44.146,53.013,17.025,29.047,52]tetraheptaconta-3,5,7(74),9,36(73),37,39,42,44(72),47(52),48,50,53(71)-tridecaen-63-yl]methylamino]-3-oxopropoxy]ethoxy]ethyl-trimethylazanium
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C81H105FN15O15S2+
|
1
|
1 |
EC50 > 22000 nM
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|
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CP0741284
|
bromosulphophthalein
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C20H8Br4Na2O10S2
|
2
|
1 |
IC50 = 50 nM
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|
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2 |
Km = 140 nM
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CP0053690
|
(3S,6S,9S,12R,15S,18S,21S,24S,27R,30S,33S)-25,30-diethyl-33-((1R,2R)-1-hydroxy-2-methylhex-4-enyl)-6,9,18-triisobutyl-3,21,24-triisopropyl-1,4,7,10,12,15,19,27,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecaone
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C63H113N11O12
|
1
|
1 |
IC50 = 180 nM
|
|
|
CP0383317
|
CB-01-11
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C37H47NO12
|
1
|
1 |
IC50 = 230 nM
|
|
|
CP0071702
|
BA-41166E
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C43H58N4O12
|
3
|
1 |
IC50 = 300 nM
|
|
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2 |
IC50 = 2200 nM
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|
|
3 |
IC50 = 2300 nM
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CP0071076
|
(3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid
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C33H35FN2O5
|
3
|
1 |
IC50 = 600 nM
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|
|
2 |
IC50 = 800 nM
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|
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3 |
IC50 = 1600 nM
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CP0036175
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1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[(2S)-3-methyl-2-{[methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})carbamoyl]amino}butanamido]-1,6-diphenylhexan-2-yl]carbamate
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C37H48N6O5S2
|
3
|
1 |
IC50 = 700 nM
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|
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2 |
IC50 = 1000 nM
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|
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3 |
IC50 = 5000 nM
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CP0036222
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(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33-[(1R,2R,4E)-1-hydroxy-2-methylhex-4-en-1-yl]-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-bis(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecone
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C62H111N11O12
|
3
|
1 |
IC50 = 700 nM
|
|
|
2 |
IC50 = 1200 nM
|
|
|
3 |
Ki = 200 nM
|
|
|
CP0906809
|
Atorvastatin acid
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C66H70F2N4O10
|
1
|
1 |
IC50 = 870 nM
|
|
|
CP0525905
|
Antamanide
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C64H78N10O10
|
1
|
1 |
IC50 = 1000 nM
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|
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CP0000815
|
Rapamycin C-7, analog 4
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C51H79NO13
|
1
|
1 |
IC50 = 1100 nM
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|
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CP0281104
|
(3S,6S,9S,12R,15S,18S,21S,24S,27R,30S,33S)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-methylhex-4-enyl]-24-[(2S)-1-[4-(2-methoxyethyl)piperazin-1-yl]propan-2-yl]-1,4,7,10,12,15,19,25,27,28-decamethyl-6,9,18-tris(2-methylpropyl)-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
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C69H125N13O13
|
1
|
1 |
IC50 = 1200 nM
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|
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CP0002800
|
1-((p-(2-(5-chloro-o-anisamido)ethyl)phenyl)sulfonyl)-3-cyclohexylurea
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C23H28ClN3O5S
|
3
|
1 |
IC50 = 1400 nM
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|
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2 |
IC50 = 2200 nM
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3 |
IC50 = 21000 nM
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CP0098465
|
2-methyl-N-[(2-methylpropan-2-yl)oxy]-4-[[(1R,2R)-2-[4-(5-methyl-1H-pyrazol-3-yl)benzoyl]cyclohexanecarbonyl]amino]pyrazole-3-carboxamide
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C27H34N6O4
|
1
|
1 |
IC50 = 1400 nM
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|
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CP0063832
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(1R,2R)-2-[4-(5-methyl-1H-pyrazol-3-yl)benzoyl]-N-(4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-3-yl)cyclohexane-1-carboxamide
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C24H26N6O3
|
1
|
1 |
IC50 = 2300 nM
|
|
|
CP0098466
|
(1R,2R)-2-[4-(5-methyl-1H-pyrazol-3-yl)benzoyl]-N-(1-methyl-5-sulfamoylpyrazol-4-yl)cyclohexane-1-carboxamide
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C22H26N6O4S
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1
|
1 |
IC50 = 2500 nM
|
|
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CP0515547
|
5-(4-Fluoro-phenyl)-1-[2-(4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-2-isopropyl-4-phenyl-1H-pyrrole-3-carboxylic acid phenylamide
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C33H33FN2O4
|
1
|
1 |
IC50 = 2600 nM
|
|
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CP0415966
|
(3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-[(2,2-dimethylbutanoyl)oxy]-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid
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C25H40O6
|
1
|
1 |
IC50 = 3600 nM
|
|
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CP0666814
|
FK-506
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C44H69NO12
|
1
|
1 |
IC50 = 3700 nM
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|
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CP0415967
|
MEVINOLINIC ACID
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C24H38O6
|
1
|
1 |
IC50 = 4000 nM
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CP0050782
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(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate
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C25H38O5
|
4
|
1 |
IC50 = 4400 nM
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|
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2 |
IC50 = 6000 nM
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3 |
IC50 = 9700 nM
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4 |
IC50 = 11000 nM
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CP0014077
|
2,2-Dimethyl-5-(2,5-dimethylphenoxy)valeriansaeure
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C15H22O3
|
2
|
1 |
IC50 = 11000 nM
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|
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2 |
IC50 = 38000 nM
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CP0005348
|
LOVASTATIN
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C24H36O5
|
1
|
1 |
IC50 = 28000 nM
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CP0036382
|
CAS_52-53-9
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C27H38N2O4
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3
|
1 |
IC50 = 32000 nM
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|
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2 |
IC50 = 64000 nM
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3 |
Ki = 52000 nM
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CP0423672
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(3S,6S)-6-[3-[2-[[3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-2-yl]methyl]-5-[(Z)-(3-ethenyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoyloxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
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C39H44N4O12
|
1
|
1 |
Km = 100 nM
|
|
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CP0847448
|
Bilirubin bisglucuronide
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C45H52N4O18
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1
|
1 |
Km = 280 nM
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CP0256501
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17beta-Estradiol-17-(beta-D-glucuronide)
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C24H32O8
|
1
|
1 |
Km = 3600 nM
|
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CP0376684
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CAS_147511-69-1
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C25H24FNO4
|
1
|
1 |
Km = 4800 nM
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CP0127632
|
ESTRONE
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C18H22O5S
|
1
|
1 |
Km = 12500 nM
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CP0253768
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[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfate
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C19H28O5S
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1
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1 |
Km = 21500 nM
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CP0848733
|
Phalloidin
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C34H46N8O11S
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1
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1 |
Km = 39000 nM
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