Ki Summary

Reaction Details

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Target

17-beta-hydroxysteroid dehydrogenase type 2

Ligand

BDBM50385878

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_823597 (CHEMBL2044598)

IC50

391±n/a nM

Citation

Henn, C; Einspanier, A; Marchais-Oberwinkler, S; Frotscher, M; Hartmann, RW Lead optimization of 17ß-HSD1 inhibitors of the (hydroxyphenyl)naphthol sulfonamide type for the treatment of endometriosis. J Med Chem55:3307-18 (2012) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

17-beta-hydroxysteroid dehydrogenase type 2

Name:

17-beta-hydroxysteroid dehydrogenase type 2

Synonyms:

Type:

Oxidoreductase; single-pass type II membrane protein

Mol. Mass.:

42795.29

Organism:

Homo sapiens (Human)

Description:

Enzyme was partially purified from human placenta.

Residue:

387

Sequence:

MSTFFSDTAWICLAVPTVLCGTVFCKYKKSSGQLWSWMVCLAGLCAVCLLILSPFWGLIL
FSVSCFLMYTYLSGQELLPVDQKAVLVTGGDCGLGHALCKYLDELGFTVFAGVLNENGPG
AEELRRTCSPRLSVLQMDITKPVQIKDAYSKVAAMLQDRGLWAVINNAGVLGFPTDGELL
LMTDYKQCMAVNFFGTVEVTKTFLPLLRKSKGRLVNVSSMGGGAPMERLASYGSSKAAVT
MFSSVMRLELSKWGIKVASIQPGGFLTNIAGTSDKWEKLEKDILDHLPAEVQEDYGQDYI
LAQRNFLLLINSLASKDFSPVLRDIQHAILAKSPFAYYTPGKGAYLWICLAHYLPIGIYD
YFAKRHFGQDKPMPRALRMPNYKKKAT

BDBM50385878

n/a

Name

BDBM50385878

Synonyms:

CHEMBL2040856

Type

Small organic molecule

Emp. Form.

C30H21NO4S

Mol. Mass.

491.557

SMILES

Oc1cccc(c1)-c1ccc2c(c(O)ccc2c1)-c1cccc2n(ccc12)S(=O)(=O)c1ccccc1 |(4.01,8.19,;4.01,6.65,;5.34,5.88,;5.34,4.34,;4,3.57,;2.67,4.34,;2.67,5.88,;1.33,3.57,;1.33,2.03,;-0,1.27,;-1.34,2.04,;-2.67,1.27,;-4,2.04,;-5.34,1.27,;-4,3.58,;-2.67,4.35,;-1.33,3.58,;0,4.35,;-2.67,-.27,;-4.01,-1.04,;-4.01,-2.58,;-2.68,-3.35,;-1.34,-2.58,;.12,-3.06,;1.03,-1.82,;.13,-.57,;-1.34,-1.04,;.6,-4.53,;1.93,-3.76,;1.93,-5.3,;-.49,-5.61,;-1.98,-5.22,;-3.07,-6.3,;-2.67,-7.79,;-1.18,-8.19,;-.09,-7.1,)|

Structure