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Target
11-beta-hydroxysteroid dehydrogenase type 2
Ligand
BDBM50193796
Substrate
n/a
Meas. Tech.
ChEMBL_424104 (CHEMBL856750)
IC50
1600±n/a nM
Citation
 Yeh, VS; Kurukulasuriya, R; Fung, S; Monzon, K; Chiou, W; Wang, J; Stolarik, D; Imade, H; Shapiro, R; Knourek-Segel, V; Bush, E; Wilcox, D; Nguyen, PT; Brune, M; Jacobson, P; Link, JT Discovery of orally active butyrolactam 11beta-HSD1 inhibitors. Bioorg Med Chem Lett 16:5555-60 (2006) [PubMed]  Article 
Target
Name:
11-beta-hydroxysteroid dehydrogenase type 2
Synonyms:
11-DH2 | 11-beta-HSD2 | 11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2) | 11-beta-hydroxysteroid dehydrogenase type 2 | Corticosteroid 11-beta-dehydrogenase isozyme 2 | DHI2_MOUSE | Hsd11b2 | Hsd11k | NAD-dependent 11-beta-hydroxysteroid dehydrogenase
Type:
Enzyme
Mol. Mass.:
42201.46
Organism:
Mus musculus (mouse)
Description:
Purified recombinant mouse 11beta-HSD2.
Residue:
386
Sequence:
MERWPWPSGGAWLLVAARALLQLLRSDLRLGRPLLAALALLAALDWLCQRLLPPPAALVVLAGAGWIALSRLARPPRLPVATRAVLITGCDTGFGKETAKKLDAMGFTVLATVLDLNSPGALELRDLCSPRLKLLQMDLTKAEDISRVLEITKAHTASTGLWGLVNNAGLNIVVADVELSPVATFRKCMEVNFFGALELTKGLLPLLRHSRGRIVTVGSPAGDMPYPCLAAYGTSKAAIALLMDTFGCELLPWGIKVSIIKPGCFKTDAVTNVNLWEKRKQLLLANIPRELLQAYGEDYIEHVHGQFLNSLRMALPDLSPVVDAIIDALLAAQPRSRYYPGRGLGLMYFIHHYLPEGLRRCFLQNFFINHLLPRALRPGQHGPAPA
  
Inhibitor
Name:
BDBM50193796
Synonyms:
3,3-dimethyl-1-[5-(1H-tetrazol-5-yl)-adamantan-2-yl]-4-(5-trifluoromethyl-pyridin-2-yloxymethyl)-pyrrolidin-2-one | CHEMBL218570
Type:
Small organic molecule
Emp. Form.:
C24H29F3N6O2
Mol. Mass.:
490.5213
SMILES:
CC1(C)C(COc2ccc(cn2)C(F)(F)F)CN([C@H]2C3CC4CC2C[C@](C4)(C3)c2nnn[nH]2)C1=O |wU:18.18,wD:25.31,TLB:18:19:26:22.23.24,17:18:26.21.22:24,THB:20:21:24:27.19.18,20:19:26.21.22:24,18:23:26:27.20.19,(18.43,-20.09,;17.11,-19.33,;17.56,-17.86,;16.63,-20.79,;17.54,-22.04,;19.08,-22,;19.87,-23.32,;19.13,-24.66,;19.92,-25.98,;21.47,-25.95,;22.21,-24.59,;21.41,-23.28,;22.22,-27.27,;22.98,-28.6,;20.89,-28.03,;23.55,-26.51,;15.09,-20.79,;14.62,-19.33,;13.15,-18.85,;11.84,-19.44,;10.31,-18.85,;10.25,-17.31,;11.7,-16.79,;13.16,-17.32,;12.16,-16.14,;10.72,-16.73,;9.31,-16.1,;10.85,-18.26,;10.72,-15.19,;11.96,-14.27,;11.48,-12.8,;9.93,-12.82,;9.46,-14.29,;15.86,-18.42,;15.86,-16.88,)|
Structure:
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