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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50239618   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50239618
PNG
(CHEMBL4079620)
Show SMILES CC1(O)C2CC3CC(C2)C(CC(=O)N2CC(O)C2)(C1C3)c1ccc(F)cc1 |TLB:2:1:9:19.5.6,4:5:9:8.1.3,10:9:6:8.3.4,20:9:8.1.3:19.5.6,THB:1:18:6:8.3.4,1:3:9.18.19:6,4:3:9:19.5.6,10:9:8.1.3:19.5.6,20:9:6:8.3.4|
Show InChI InChI=1S/C22H28FNO3/c1-21(27)15-6-13-7-16(9-15)22(19(21)8-13,14-2-4-17(23)5-3-14)10-20(26)24-11-18(25)12-24/h2-5,13,15-16,18-19,25,27H,6-12H2,1H3
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Inhibition of 11beta-HSD1 in human microsomes using [3H]cortisone as substrate preincubated for 10 mins followed by substrate addition measured after...


J Med Chem 60: 4932-4948 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00211
BindingDB Entry DOI: 10.7270/Q2DV1N23
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Mus musculus (mouse))
BDBM50239618
PNG
(CHEMBL4079620)
Show SMILES CC1(O)C2CC3CC(C2)C(CC(=O)N2CC(O)C2)(C1C3)c1ccc(F)cc1 |TLB:2:1:9:19.5.6,4:5:9:8.1.3,10:9:6:8.3.4,20:9:8.1.3:19.5.6,THB:1:18:6:8.3.4,1:3:9.18.19:6,4:3:9:19.5.6,10:9:8.1.3:19.5.6,20:9:6:8.3.4|
Show InChI InChI=1S/C22H28FNO3/c1-21(27)15-6-13-7-16(9-15)22(19(21)8-13,14-2-4-17(23)5-3-14)10-20(26)24-11-18(25)12-24/h2-5,13,15-16,18-19,25,27H,6-12H2,1H3
PDB
MMDB

Reactome pathway
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UniProtKB/SwissProt

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DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Inhibition of mouse 11beta-HSD1


J Med Chem 60: 4932-4948 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00211
BindingDB Entry DOI: 10.7270/Q2DV1N23
More data for this
Ligand-Target Pair