Target Poor or Non Binder(s) Information
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T33489 | Target Info | |||
| Target Name | Steryl-sulfatase (STS) | ||||
| Synonyms |
Steryl-sulfate sulfohydrolase; Steroid sulfatase; STS; Estrone sulfatase; Arylsulfatase C; ASC
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| Target Type | Successful Target | ||||
| Gene Name | STS | ||||
| Biochemical Class | Sulfuric ester hydrolase | ||||
| UniProt ID | |||||
| Poor Binders of This Target (in total, 51 binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
Estrone
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|
Approved | Compound Info | ||
| Synonyms |
Aquacrine; Crinovaryl; Cristallovar; Crystogen; Destrone; Disynformon; Endofolliculina; Esterone; Estrin; Estrol; Estron; Estrona; Estronum; Estrovarin; Estrugenone; Estrusol; Femidyn; Fermidyn; Folikrin; Folipex; Folisan; Follestrine; Follestrol; Folliculin; Folliculine; Follicunodis; Glandubolin; Hiestrone; Hormestrin; Hormofollin; Hormovarine; Kestrone; Ketodestrin; Ketohydroxyestrin; Ketohydroxyoestrin; Ketophydroxyestrin; Kolpon; Menagen; Menformon; Mestronaq; OESTRONE; Oestrin; Oestroform; Oestronum; Oestroperos; Ovifollin; Perlatan; Solliculin; Theelin; Thelestrin; Thelykinin; Thynestron; Tokokin; Unden; Unigen; Wehgen; Wynestron; Estrogenic Substance; Estrona [Spanish]; Femestrone injection; Follicular hormone; Folliculine benzoate; Hauck Brand of Estrone; Hyrex Brand of Estrone; Menformon A; Oestrone [Steroidal oestrogens]; Penncap M; Vortech Brand of Estrone; WynestronPencap M; CMC_13458; E 9750; E0026; E(sub 1); Estrona [INN-Spanish]; Estrone (E1); Estrone (TN); Estrone [USAN:INN]; Estrone-A; Estronum [INN-Latin]; Femestrone inj.; Ketohydroxy-Estratriene; NATURAL ESTROGENIC SUBSTANCE-ESTRONE; Oestrone, Estrone; Ovex (tablets); Unden (pharmaceutical); Unden (pharmaceutical) (VAN); Estrone (JAN/USP/INN); Estrone, (8 alpha)-Isomer; Estrone, (9 beta)-Isomer; Estrone, (+-)-Isomer; [2,4,6,7-3H]-E1; Delta-1,3,5-Estratrien-3beta-ol-17-one; Delta-1,3,5-Oestratrien-3beta-ol-17-one; Delta-1,3,5-estratrien-3-beta-ol-17-one; Delta-1,3,5-oestratrien-3-beta-ol-17-one; (13S)-3-hydroxy-13-methyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one; (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one; 1,3,5(10)-Estratrien-3-ol-17-one; 1,3,5(10)-Oestratrien-3-ol-17-one; 3-Hydroxy-1,3,5(10)-estratrien-17-one; 3-Hydroxy-17-keto-estra-1,3,5-triene; 3-Hydroxy-17-keto-oestra-1,3,5-triene; 3-Hydroxy-oestra-1,3,5(10)-trien-17-one; 3-Hydroxyestra-1,3,5(10)-trien-17-one; 3-Hydroxyestra-1,3,5(10)-triene-17-one; 3-hydroxy-estra-1,3,5(10)-trien-17-one
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| Activity |
IC50 = 51000 nM
|
[1] | |||
| Compound Name |
Estradiol
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|
Approved | Compound Info | ||
| Synonyms |
Aerodiol; Alora; Altrad; Aquadiol; Bardiol; Climaderm; Climara; Compudose; Corpagen; Dermestril; Destradiol; Dihydrofolliculin; Dihydromenformon; Dihydrotheelin; Dihydroxyesterin; Dihydroxyestrin; Dihydroxyoestrin; Dimenformon; Diogyn; Diogynets; Divigel; Elestrin; Encore; Esclim; Estrace; Estraderm; Estradiolo; Estradiolum; Estradot; Estraldine; Estrasorb; Estreva; Estrifam; Estring; Estroclim; Estrodiolum; Estrogel; Estrovite; Evamist; Evorel; Extrasorb; Femanest; Femestral; Femestrol; Fempatch; Femtran; Follicyclin; Gelestra; Ginedisc; Ginosedol; GynPolar; Gynergon; Gynestrel; Gynodiol; Gynoestryl; Innofem; Lamdiol; Macrodiol; Macrol; Menest; Menorest; Microdiol; Nordicol; Oesclim; Oestergon; Oestradiol; Oestradiolum; Oestrogel; Oestroglandol; Oestrogynal; Ovahormon; Ovasterol; Ovastevol; Ovociclina; Ovocyclin; Ovocycline; Ovocylin; Perlatanol; Polyestradiol; Primofol; Profoliol; Progynon; Syndiol; Systen; Tradelia; Trocosone; Vagifem; Vivelle; Zerella; Zesteem; Zesteen; Zumenon; Climara Forte; Component of Menrium; Estraderm MX; Estraderm TTS; Estradiolo [DCIT]; Estradiolum [INN]; Estring vaginal ring; Estrofem Forte; Oestradiol Berco; Oestradiol R; Progynon DH; Sandrena Gel; Sisare Gel; Trial SAT; CMC_11154; Compudose 200; Compudose 365; E 2; E 8875; E0025; Epiestriol 50; Estraderm TTS 100; Estraderm TTS 50; Estrapak 50; Estroclim 50; Estrofem 2; Sandrena 1; [3H]]estradiol; Activella (TN); Alora (TN); Alpha-Oestradiol; AngeliQ (TN); B-Estradiol; Beta-Estradiol; Beta-Oestradiol; Beta-estradiol; Cis-Estradiol; Cis-Oestradiol; Climara (TN); D-Estradiol; D-Oestradiol; Divigel (TN); E(sub 2); Elestrin (TN); Estrace (TN); Estraderm (TN); Estraderm TTS (TN); Estradiol [USAN:INN]; Estradiol acetate (TN); Estradiol cypionate (TN); Estradiol valerate (TN); Estradiol-17 beta; Estradiol-17beta; Estrasorb (TN); Estrasorb Topical (TN); Estring (TN); Estrofem (TN); Estrogel (TN); EvaMist (TN); Femring (TN); Innofem (TN); Menostar (TN); Oestradiol-17beta; Progynon-DH; Progynova (TN); S-21400; SK-Estrogens; SL-1100; VIVELLE-DOT; Vagifem (TN); Vivelle (TN); [3H]-estradiol; Estradiol-17-beta; Estradiol-3,17beta; Oestradiol-17-beta; Vivelle-Dot (TN); D-3,17beta-Estradiol; [2,4,6,7-3H]-E2; 17 beta-Estradiol; 17-.BETA.-Estradiol; 17-beta-OH-estradiol; 17-beta-estradiol; 17.beta.-Estradiol; 17.beta.-Oestradiol; 17b-Oestradiol; 17beta oestradiol; 17beta-Estradiol; 17beta-Oestradiol; 3,17-beta-Estradiol; 3,17-beta-Oestradiol; 3,17.beta.-Estradiol; 3,17beta-Estradiol
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| Activity |
IC50 = 84000 nM
|
[2] | |||
| Compound Name |
[3H]estrone-3-sulphate
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Investigative | Compound Info | ||
| Synonyms |
[3H]-estrone hydrogen sulfate; [3H]-estrone-3-sulphate; [3H]estrone-3-sulfate
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| Activity |
Ki = 60000 nM
|
[3] | |||
| Compound Name |
2-Adamantan-1-yl-4-oxo-4H-chromene-6-carboxylic acid methyl ester
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL185877; BDBM50151139
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| Activity |
Ki ~ 50000 nM
|
[4] | |||
| Compound Name |
O-[[(8R,9S,13S,14S)-13-Methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]] carbamothioate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1628057; BDBM50370419
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
[(8R,9S,13S,14S)-13-Methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] 2-aminoacetate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1627730; BDBM50370416
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
3-[(E)-(Dodecylcarbamothioylhydrazinylidene)methyl]-1,9,11,14-tetrahydroxy-7-methoxy-10-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL285011; BDBM50112857
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| Activity |
IC50 = 50000 nM
|
[6] | |||
| Compound Name |
[(8R,9S,13S,14S)-13-Methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] N-benzylcarbamate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1627726; BDBM50370423
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
(2-Adamantan-1-yl-4-oxo-4H-chromen-6-yl)-acetic acid
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL361924; BDBM50151138
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| Activity |
Ki ~ 50000 nM
|
[4] | |||
| Compound Name |
Phenyl-acetic acid (1R,3R,5S)-8-(4-fluoro-benzenesulfonylaminocarbonyl)-8-aza-bicyclo[3.2.1]oct-3-yl ester
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL122686; BDBM50134327
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| Activity |
IC50 = 50000 nM
|
[7] | |||
| Compound Name |
[(8R,9S,13S,14S)-13-Methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] carbamate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1628189; BDBM50370418
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|
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
[(8R,9S,13S,14S)-13-Methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] cyanate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1627995; SCHEMBL217968; BDBM50370421
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
[(8R,9S,13S,14S)-13-Methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1627727; BDBM50370417
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
2-Adamantan-1-yl-4-oxo-4H-thiochromene-6-carbonitrile
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL361700; BDBM50151136
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| Activity |
Ki ~ 50000 nM
|
[4] | |||
| Compound Name |
Estrone acetate
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Investigative | Compound Info | ||
| Synonyms |
Estrone 3-acetate; UNII-4L6USG266B; Oestrone-3-acetate; 4L6USG266B; CHEMBL1627997; Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-; Acetoxyestrone; Hogival; ESTRONEACETATE; Puboestrene; 3-Acetoxyestrone; 3-Acetoxyestrone R; Estrone 3-O-acetate; SCHEMBL603954; ZINC1375; CTK6A2222; KS-00002B8H; 2676AF; BDBM50370422; AKOS024374937; SS-4431; ST51014999; 3-Acetoxy-17-oxo-estra-1,3,5(10)-triene; 3-Hydroxyestra-1,3,5(10)-17-one acetate; 17-Oxo-1,3,5(10)-estratrien-3-yl acetate; 17-oxoestra-1,3,5(10)-trien-3-yl acetate; 3Beta-acetoxyestra-1,3,5(10)-trien-17-one; 17-Oxoestra-1(10),2,4-trien-3-yl acetate #; Q27259970
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| Activity |
IC50 ~ 50000 nM
|
[5] | |||
| Compound Name |
2-Adamantan-1-yl-4-oxo-4H-chromene-6-carboxylic acid amide
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL183996; BDBM50151143
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| Activity |
Ki ~ 50000 nM
|
[4] | |||
| Compound Name |
Difluoro-[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]methanesulfonic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1628110; BDBM50366886
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| Activity |
Ki = 57000 nM
|
[3] | |||
| Compound Name |
3-(4-Butylthiosemicarbazono)methyl-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL376171; BDBM50216106
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| Activity |
IC50 = 58000 nM
|
[8] | |||
| Compound Name |
2-(4-Cyclooctylthiosemicarbazono)methyl-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL228315; BDBM50216117
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| Activity |
IC50 = 60000 nM
|
[8] | |||
| Compound Name |
4-(3-Chloro-benzenesulfonylaminocarbonyl)-piperidine-1-carboxylic acid tert-butyl ester
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL367827; BDBM50161126
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| Activity |
IC50 = 71000 nM
|
[9] | |||
| Compound Name |
3-(1H-Tetrazole-5-ylmethyl)estra-1,3,5(10)-triene-17-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1627836; BDBM50366888
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| Activity |
Ki = 72700 nM
|
[3] | |||
| Compound Name |
7-[Amino-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]phosphinothioyl]oxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3612350; BDBM50116182
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| Activity |
IC50 = 74330 nM
|
[10] | |||
| Compound Name |
7-[Methoxy-[(4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl)oxy]phosphinothioyl]oxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3612305; BDBM50116192
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| Activity |
IC50 = 75020 nM
|
[10] | |||
| Compound Name |
1-(2,3,4,5,6-Pentafluorobenzyl)-2-[4-(sulfooxy)phenyl]-3-methyl-4-(trifluoromethyl)-1H-indol-6-ol 6-sulfate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1159897
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| Activity |
IC50 = 80000 nM
|
[11] | |||
| Compound Name |
(8R,9S,13S,14S)-3-[Difluoro(prop-2-enylsulfonyl)methyl]-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3806064; BDBM50168214
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| Activity |
Ki = 82000 nM
|
[12] | |||
| Compound Name |
(8R,9S,13S,14S,17R)-17-Benzyl-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-4-carbaldehyde
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL1835425; BDBM50355360
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| Activity |
Ki = 85000 nM
|
[1] | |||
| Compound Name |
3-[Amino-[(6-oxo-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-3-yl)oxy]phosphinothioyl]oxy-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-6-one
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL3612352; BDBM50116175
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| Activity |
IC50 = 88830 nM
|
[10] | |||
| Compound Name |
2,2-Dimethyl-propionic acid (1R,3R,5S)-8-(4-chloro-benzenesulfonylaminocarbonyl)-8-aza-bicyclo[3.2.1]oct-3-yl ester
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL426236; BDBM50161129
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| Activity |
IC50 ~ 100000 nM
|
[9] | |||
| Compound Name |
6-(4-Cyclohexylthiosemicarbazono)methyl-2-methoxy-3-methyl-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL414108; BDBM50216101
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
1,9,11,14-Tetrahydroxy-7-methoxy-10-methyl-8,13-dioxo-3-(phenoxycarbonyl-hydrazonomethyl)-5,6,8,13-tetrahydro-benzo[a]naphthacene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL26959; BDBM50112877
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| Activity |
IC50 ~ 100000 nM
|
[6] | |||
| Compound Name |
4-(2-Chloro-benzenesulfonylaminocarbonyl)-piperidine-1-carboxylic acid tert-butyl ester
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL180910; BDBM50161125
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| Activity |
IC50 ~ 100000 nM
|
[9] | |||
| Compound Name |
Phenyl-acetic acid 1-(4-chloro-benzenesulfonylaminocarbonyl)-piperidin-4-yl ester
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL120867; BDBM50134326
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| Activity |
IC50 ~ 100000 nM
|
[7] | |||
| Compound Name |
3-[(E)-(Carbamothioylhydrazinylidene)methyl]-1,9,11,14-tetrahydroxy-7-methoxy-10-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL283933; BDBM50112878
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| Activity |
IC50 ~ 100000 nM
|
[6] | |||
| Compound Name |
4-(4-Chloro-benzenesulfonylaminocarbonyl)-piperazine-1-carboxylic acid benzyl ester
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL179284; BDBM50161128
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| Activity |
IC50 ~ 100000 nM
|
[9] | |||
| Compound Name |
4H-1-Benzopyran-4-one, 7-[(aminosulfonyl)oxy]-2-propyl-
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL137461; BDBM50118552; Sulfamic acid 4-oxo-2-propyl-4H-chromen-7-yl ester
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| Activity |
IC50 ~ 100000 nM
|
[13] | |||
| Compound Name |
1,9,11,14-Tetrahydroxy-7-methoxy-10-methyl-8,13-dioxo-3-[(E)-(phenylcarbamoylhydrazinylidene)methyl]-5,6-dihydrobenzo[a]tetracene-2-carboxylic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL26360; BDBM50112869
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| Activity |
IC50 ~ 100000 nM
|
[6] | |||
| Compound Name |
2-[1-(4-Cyclohexylthiosemicarbazono)ethyl]-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL229060; BDBM50216103
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
6-(4-Cyclohexylthiosemicarbazono)methyl-2,3-dimethoxy-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL406581; BDBM50216124
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
3-(4-Cyclohexylsemicarbazono)methyl-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL229011; BDBM50216122
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
2-(4-Cyclohexylthiosemicarbazono)methyl-benzeneboronic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL228743; BDBM50216111
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
[(1R,5S)-8-(Benzenesulfonylcarbamoyl)-8-azabicyclo[3.2.1]octan-3-yl] 2-phenylacetate
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL123397; BDBM50134334; Phenyl-acetic acid (1R,3R,5S)-8-benzenesulfonylaminocarbonyl-8-aza-bicyclo[3.2.1]oct-3-yl ester
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| Activity |
IC50 ~ 100000 nM
|
[7] | |||
| Compound Name |
2-(4-Cyclopropylthiosemicarbazono)methyl-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL228796; BDBM50216098
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
2-(4-Cyclohexylthiosemicarbazono)methyl-6-methoxy-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL228861; BDBM50216104
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
2-(4-Phenylthiosemicarbazono)methyl-benzoic acid
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Investigative | Compound Info | ||
| Synonyms |
CHEMBL228316; ZINC5237149; BDBM50216107
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| Activity |
IC50 ~ 100000 nM
|
[8] | |||
| Compound Name |
3-[Amino-[(6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]phosphinothioyl]oxy-7,8,9,10-tetrahydrobenzo[c]chromen-6-one
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL3612351; BDBM50116180
Click to Show/Hide
|
||||
| Activity |
IC50 = 109970 nM
|
[10] | |||
| Compound Name |
(8R,9S,13S,14S)-13-Methyl-2-methylsulfanyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3-sulfonic acid amide
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL362734; SCHEMBL3967814; BDBM50171445
Click to Show/Hide
|
||||
| Activity |
IC50 = 120000 nM
|
[14] | |||
| Compound Name |
Sulfamic acid 3-iodophenyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL24063; (3-iodophenyl) sulfamate; SCHEMBL9451299; Sulfamic acid 3-iodo-phenyl ester; BDBM50112406
Click to Show/Hide
|
||||
| Activity |
IC50 = 120000 nM
|
[15] | |||
| Compound Name |
3-Nitrophenyl Sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL283560; Sulfamic acid 3-nitrophenyl ester; (3-nitrophenyl) sulfamate; SCHEMBL9451297; Sulfamic acid 3-nitro-phenyl ester; BDBM50098109
Click to Show/Hide
|
||||
| Activity |
IC50 = 120000 nM
|
[15] | |||
| Compound Name |
17-Oxoestra-1,3,5(10)-triene-3-methanesulfonic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1628109; BDBM50366884
Click to Show/Hide
|
||||
| Activity |
Ki = 140000 nM
|
[3] | |||
| Compound Name |
(8R,9S,13S,14S)-2-Bromo-3-hydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-4-carbaldehyde
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1835632; BDBM50355364
Click to Show/Hide
|
||||
| Activity |
IC50 = 145000 nM
|
[1] | |||
| Compound Name |
3-Cyanophenyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL23306; Sulfamic acid 3-cyanophenyl ester; Sulfamic acid, 3-cyanophenyl ester; (3-cyanophenyl) sulfamate; SCHEMBL4599111; Sulfamic acid 3-cyano-phenyl ester; BDBM50098099
Click to Show/Hide
|
||||
| Activity |
IC50 = 190500 nM
|
[16] | |||
| Click to Show/Hide the Information of All Poor Binders | |||||
| Non Binders of This Target (in total, 19 non binders) | Download | Top | |||
|---|---|---|---|---|---|
| Compound Name |
PHENYLSULFAMATE
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
phenyl sulfamate; phenylsulfamate; Sulfamic acid phenyl ester; Sulfamic acid, phenyl ester; 19792-91-7; CHEMBL24259; MLS001106216; SCHEMBL605969; CTK0E0669; DTXSID50452510; XOIYZMDJFLKIEI-UHFFFAOYSA-N; HMS3328F04; HMS2205G22; ZINC1537101; BDBM50098106; AKOS023879266; SMR000639519; DB-009256
Click to Show/Hide
|
||||
| Activity |
IC50 > 10000000 nM
|
[15] | |||
| Compound Name |
3-Hydroxy-17-oxoestra-1,3,5(10)-triene-4-carboxylic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1835537; BDBM50355365
Click to Show/Hide
|
||||
| Activity |
IC50 = 215000 nM
|
[1] | |||
| Compound Name |
(8R,9S,13S,14S)-3-Hydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-2,4-dicarbaldehyde
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL1835545; BDBM50355373
Click to Show/Hide
|
||||
| Activity |
IC50 = 224000 nM
|
[1] | |||
| Compound Name |
4-Formylphenyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL82508; (4-formylphenyl) sulfamate; SCHEMBL6798661; Sulfamic acid 4-formyl-phenyl ester; BDBM50097925; Amidosulfuric acid 4-formylphenyl ester
Click to Show/Hide
|
||||
| Activity |
IC50 = 254000 nM
|
[17] | |||
| Compound Name |
Sulfamic acid 3-bromophenyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL23305; Sulfamic acid, 3-bromophenyl ester; (3-bromophenyl) sulfamate; 3-Bromophenyl sulfamate; ACMC-20mw23; SCHEMBL9451374; CTK0F3927; DTXSID90659182; Sulfamic acid 3-bromo-phenyl ester; BDBM50098104
Click to Show/Hide
|
||||
| Activity |
IC50 = 257000 nM
|
[15] | |||
| Compound Name |
Sulfamic acid 4-[(E)-(3-phenyl-acryloyl)]-phenyl ester
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|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL85468; BDBM50097933; Amidosulfuric acid 4-trans-cinnamoylphenyl ester; Amidosulfuric acid 4-(3-phenylacryloyl)phenyl ester
Click to Show/Hide
|
||||
| Activity |
IC50 = 263000 nM
|
[17] | |||
| Compound Name |
Sulfamic acid, 4-cyanophenyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL24119; Sulfamic acid 4-cyanophenyl ester; 4-cyanophenyl sulfamate; (4-cyanophenyl) sulfamate; SCHEMBL9451286; Sulfamic acid 4-cyano-phenyl ester; BDBM50098113; ZINC13440977
Click to Show/Hide
|
||||
| Activity |
IC50 = 300000 nM
|
[15] | |||
| Compound Name |
Sulfamic acid 4-acetylphenyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL85506; (4-acetylphenyl) sulfamate; Sulfamic acid 4-acetyl-phenyl ester; BDBM50097932
Click to Show/Hide
|
||||
| Activity |
IC50 = 302000 nM
|
[17] | |||
| Compound Name |
4-Nitrophenyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL23258; Sulfamic acid, 4-nitrophenyl ester; MFCD32220426; ACMC-20mbla; (4-nitrophenyl) sulfamate; SCHEMBL3519559; CTK0G2692; DTXSID20439616; Sulfamic acid 4-nitrophenyl ester; (4-Nitrophenoxysulfonyl)amineanion; Sulfamic acid 4-nitro-phenyl ester; BDBM50098105; SY264433
Click to Show/Hide
|
||||
| Activity |
IC50 = 330000 nM
|
[15] | |||
| Compound Name |
3-Chlorophenyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL282717; Sulfamic acid 3-chlorophenyl ester; (3-chlorophenyl) sulfamate; SCHEMBL9451233; Sulfamic acid 3-chloro-phenyl ester; BDBM50098100; ZINC13440967
Click to Show/Hide
|
||||
| Activity |
IC50 = 537000 nM
|
[15] | |||
| Compound Name |
4-Fluorophenyl Sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL23865; Sulfamic acid 4-fluorophenyl ester; Sulfamic acid, 4-fluorophenyl ester; ACMC-20mw24; (4-fluorophenyl) sulfamate; SCHEMBL9451266; CTK0F3926; DTXSID30659181; Sulfamic acid 4-fluoro-phenyl ester; BDBM50098103
Click to Show/Hide
|
||||
| Activity |
IC50 = 537000 nM
|
[15] | |||
| Compound Name |
Sulfamic acid 4-iodophenyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL24120; 4-iodophenyl sulfamate; (4-iodophenyl) sulfamate; SCHEMBL9451347; Sulfamic acid 4-iodo-phenyl ester; BDBM50112403
Click to Show/Hide
|
||||
| Activity |
IC50 = 560000 nM
|
[15] | |||
| Compound Name |
2,2,2-Trichloroethyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
2,2,2-Trichloroethoxysulfonamide; Sulfamic acid, 2,2,2-trichloroethyl ester; CHEMBL23067; MFCD01683146; Cl3CCH2OSO2NH2; ACMC-209o6p; 2 2 2-TRICHLOROETHOXYSULFONAMIDE 97; Sulfamic acid trichloroethyl; SCHEMBL893732; CTK2F4529; DTXSID20219273; 2,2,2-Trichloroethoxysulfonylamine; ANW-35615; BDBM50112404; ZINC13440955; 2,2,2-Trichloroethoxysulfonamide 97%; 2,2,2-Trichloroethoxysulfonamide,97%; 2,2,2-Trichloroethoxysulfonamide, 97%; AS-62661; Sulfamic Acid 2,2,2-Trichloroethyl Ester; Sulfamic acid 2,2,2-trichloro-ethyl ester; T2646
Click to Show/Hide
|
||||
| Activity |
IC50 = 750000 nM
|
[15] | |||
| Compound Name |
4-Bromophenyl Sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL283121; SCHEMBL3379933; Sulfamic acid 4-bromophenyl ester; Sulfamic acid 4-bromo-phenyl ester; BDBM50098108
Click to Show/Hide
|
||||
| Activity |
IC50 = 912000 nM
|
[15] | |||
| Compound Name |
4-Chlorophenyl Sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL23350; Sulfamic acid, 4-chlorophenyl ester; Sulfamic acid 4-chlorophenyl ester; Sulfamic acid 4-chloro-phenyl ester; (4-chlorophenyl) sulfamate; SCHEMBL2236572; CTK0J3639; DTXSID60435652; BDBM50098102; ZINC13440965
Click to Show/Hide
|
||||
| Activity |
IC50 = 1584800 nM
|
[16] | |||
| Compound Name |
Sulfamic acid 3-fluorophenyl ester
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL23864; (3-fluorophenyl) sulfamate; SCHEMBL9451341; Sulfamic acid 3-fluoro-phenyl ester; BDBM50098112
Click to Show/Hide
|
||||
| Activity |
IC50 = 2089000 nM
|
[15] | |||
| Compound Name |
3-Methylphenyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL287279; (3-methylphenyl) sulfamate; Sulfamic acid m-tolyl ester; SCHEMBL9451450; Sulfamic acid 3-methylphenyl ester; BDBM50098107; ZINC13440959
Click to Show/Hide
|
||||
| Activity |
IC50 = 2089000 nM
|
[15] | |||
| Compound Name |
4-Methylphenyl sulfamate
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
Sulfamic acid p-tolyl ester; CHEMBL24210; Sulfamic acid, 4-methylphenyl ester; (4-methylphenyl) sulfamate; SCHEMBL9451471; CTK0J3638; DTXSID40497011; Sulfamic acid 4-methylphenyl ester; BDBM50098101; ZINC13440957
Click to Show/Hide
|
||||
| Activity |
IC50 > 10000000 nM
|
[15] | |||
| Compound Name |
[4-[2-[2-[2-(2-Aminoethoxy)ethoxy]ethylamino]-1-fluoro-2-oxoethyl]phenyl] hydrogen sulfate;azane;2,2,2-trifluoroacetic acid
Click to Show/Hide
|
Investigative | Compound Info | ||
| Synonyms |
CHEMBL2205726
Click to Show/Hide
|
||||
| Activity |
IC50 = 15000000 nM
|
[18] | |||
| Click to Show/Hide the Information of All Non Binders | |||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Inhibition of steroid sulfatase with 4-substituted estrone and estradiol derivatives. Bioorg Med Chem. 2011 Oct 15;19(20):5999-6005. | ||||
| REF 2 | Structure-activity relationships of 17alpha-derivatives of estradiol as inhibitors of steroid sulfatase. J Med Chem. 2000 Nov 16;43(23):4465-78. | ||||
| REF 3 | The difluoromethylene group as a replacement for the labile oxygen in steroid sulfates: a new approach to steroid sulfatase inhibitors. Bioorg Med Chem Lett. 2004 Jan 5;14(1):151-5. | ||||
| REF 4 | 2-(1-adamantyl)-4-(thio)chromenone-6-carboxylic acids: potent reversible inhibitors of human steroid sulfatase. J Med Chem. 2004 Aug 12;47(17):4268-76. | ||||
| REF 5 | Estrone formate: a novel type of irreversible inhibitor of human steroid sulfatase. Bioorg Med Chem Lett. 2004 Oct 4;14(19):4999-5002. | ||||
| REF 6 | A novel type of nonsteroidal estrone sulfatase inhibitors. Bioorg Med Chem Lett. 2002 May 20;12(10):1339-42. | ||||
| REF 7 | Nortropinyl-arylsulfonylureas as novel, reversible inhibitors of human steroid sulfatase. Bioorg Med Chem Lett. 2003 Nov 3;13(21):3673-7. | ||||
| REF 8 | Thiosemicarbazones of formyl benzoic acids as novel potent inhibitors of estrone sulfatase. J Med Chem. 2007 Jul 26;50(15):3661-6. | ||||
| REF 9 | N-Acyl arylsulfonamides as novel, reversible inhibitors of human steroid sulfatase. Bioorg Med Chem Lett. 2005 Feb 15;15(4):1235-8. | ||||
| REF 10 | Synthesis of bicoumarin thiophosphate derivatives as steroid sulfatase inhibitors. Eur J Med Chem. 2015 Aug 28;101:358-66. | ||||
| REF 11 | Active site directed inhibition of estrone sulfatase by nonsteroidal coumarin sulfamates. J Med Chem. 1996 Mar 29;39(7):1349-51. | ||||
| REF 12 | Sulfatase inhibitors for recidivist breast cancer treatment: A chemical review. Eur J Med Chem. 2016 May 23;114:170-90. | ||||
| REF 13 | 2-Substituted 4-(thio)chromenone 6-O-sulfamates: potent inhibitors of human steroid sulfatase. J Med Chem. 2002 Sep 12;45(19):4310-20. | ||||
| REF 14 | 2-Alkylsulfanyl estrogen derivatives: synthesis of a novel class of multi-targeted anti-tumour agents. Bioorg Med Chem Lett. 2004 Jun 21;14(12):3135-8. | ||||
| REF 15 | The mechanism of the irreversible inhibition of estrone sulfatase (ES) through the consideration of a range of methane- and amino-sulfonate-based compounds. Bioorg Med Chem Lett. 2002 May 6;12(9):1279-82. | ||||
| REF 16 | Acid dissociation constant, a potential physicochemical factor in the inhibition of the enzyme estrone sulfatase (ES). Bioorg Med Chem Lett. 2001 Apr 9;11(7):899-902. | ||||
| REF 17 | Hydrophobicity, a physicochemical factor in the inhibition of the enzyme estrone sulfatase (ES). Bioorg Med Chem Lett. 2001 Sep 17;11(18):2525-8. | ||||
| REF 18 | Evaluation of sulfatase-directed quinone methide traps for proteomics. Bioorg Med Chem. 2012 Jan 15;20(2):622-7. | ||||
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