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BDBM50195496 (4-amino-3,5-dichlorophenyl)((2R,6S)-2,6-dimethylpiperidin-1-yl)methanone::CHEMBL222668

SMILES: C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)c(N)c(Cl)c1

InChI Key: InChIKey=QIIPLBRWXZECJB-DTORHVGOSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50195496   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
11-beta-hydroxysteroid dehydrogenase 2


(Rattus norvegicus)
BDBM50195496
PNG
((4-amino-3,5-dichlorophenyl)((2R,6S)-2,6-dimethylp...)
Show SMILES C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)c(N)c(Cl)c1
Show InChI InChI=1S/C14H18Cl2N2O/c1-8-4-3-5-9(2)18(8)14(19)10-6-11(15)13(17)12(16)7-10/h6-9H,3-5,17H2,1-2H3/t8-,9+
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of rat 11beta-HSD2


Bioorg Med Chem Lett 16: 6241-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.035
BindingDB Entry DOI: 10.7270/Q2B857R4
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (Human))
BDBM50195496
PNG
((4-amino-3,5-dichlorophenyl)((2R,6S)-2,6-dimethylp...)
Show SMILES C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)c(N)c(Cl)c1
Show InChI InChI=1S/C14H18Cl2N2O/c1-8-4-3-5-9(2)18(8)14(19)10-6-11(15)13(17)12(16)7-10/h6-9H,3-5,17H2,1-2H3/t8-,9+
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human 11beta-HSD2 by SPA


Bioorg Med Chem Lett 16: 6241-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.035
BindingDB Entry DOI: 10.7270/Q2B857R4
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50195496
PNG
((4-amino-3,5-dichlorophenyl)((2R,6S)-2,6-dimethylp...)
Show SMILES C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)c(N)c(Cl)c1
Show InChI InChI=1S/C14H18Cl2N2O/c1-8-4-3-5-9(2)18(8)14(19)10-6-11(15)13(17)12(16)7-10/h6-9H,3-5,17H2,1-2H3/t8-,9+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 36n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human 11beta-HSD1 expressed in Escherichia coli by SPA


Bioorg Med Chem Lett 16: 6241-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.035
BindingDB Entry DOI: 10.7270/Q2B857R4
More data for this
Ligand-Target Pair