BindingDB logo
myBDB logout

BDBM99364 US8497281, 142::US9120769, 75::US9663470, 75

SMILES: Oc1ccc(cc1Cl)C(=O)N1CCCC2[C@@H]1CCc1ccccc21

InChI Key: InChIKey=JXGQKLMBTDWKCZ-DAFXYXGESA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 99364   
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 1


(Homo sapiens (Human))
BDBM99364
PNG
(US8497281, 142 | US9120769, 75 | US9663470, 75)
Show SMILES Oc1ccc(cc1Cl)C(=O)N1CCCC2[C@@H]1CCc1ccccc21 |r|
Show InChI InChI=1S/C20H20ClNO2/c21-17-12-14(8-10-19(17)23)20(24)22-11-3-6-16-15-5-2-1-4-13(15)7-9-18(16)22/h1-2,4-5,8,10,12,16,18,23H,3,6-7,9,11H2/t16?,18-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 324n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM99364
PNG
(US8497281, 142 | US9120769, 75 | US9663470, 75)
Show SMILES Oc1ccc(cc1Cl)C(=O)N1CCCC2[C@@H]1CCc1ccccc21 |r|
Show InChI InChI=1S/C20H20ClNO2/c21-17-12-14(8-10-19(17)23)20(24)22-11-3-6-16-15-5-2-1-4-13(15)7-9-18(16)22/h1-2,4-5,8,10,12,16,18,23H,3,6-7,9,11H2/t16?,18-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 324n/an/an/an/an/an/a



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International Gmbh

US Patent


Assay Description
In vitro inhibition of 11β-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluorescence) technology (cisbio internatio...


US Patent US9663470 (2017)


BindingDB Entry DOI: 10.7270/Q2V40X8H
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM99364
PNG
(US8497281, 142 | US9120769, 75 | US9663470, 75)
Show SMILES Oc1ccc(cc1Cl)C(=O)N1CCCC2[C@@H]1CCc1ccccc21 |r|
Show InChI InChI=1S/C20H20ClNO2/c21-17-12-14(8-10-19(17)23)20(24)22-11-3-6-16-15-5-2-1-4-13(15)7-9-18(16)22/h1-2,4-5,8,10,12,16,18,23H,3,6-7,9,11H2/t16?,18-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 324n/an/an/an/a6.0n/a



Boehringer-Ingelheim International GmbH

US Patent


Assay Description
n vitro inhibition of 11β-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluorescence) technology (cisbio internation...


US Patent US9120769 (2015)


BindingDB Entry DOI: 10.7270/Q2XW4HK9
More data for this
Ligand-Target Pair