BindingDB logo
myBDB logout

null

SMILES: CC1(CC2c3ccccc3C1c1ccccc21)C(=O)Nc1nncs1

InChI Key: InChIKey=JPBZIHJMUSXRCT-UHFFFAOYSA-N

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 2 hits for monomerid = 50249192   
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
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50249192
PNG
(15-methyl-N-(1,3,4-thiadiazol-2-yl)tetracyclo[6.6....)
Show SMILES CC1(CC2c3ccccc3C1c1ccccc21)C(=O)Nc1nncs1 |TLB:0:1:4.9:11.16,8:9:2.1:11.16,12:11:4.9:2.1,THB:17:1:4.9:11.16,(-6.83,-47.54,;-5.48,-48.31,;-4.97,-49.08,;-4.97,-51.28,;-6.84,-51.8,;-8.18,-52.57,;-9.52,-51.8,;-9.51,-50.25,;-8.19,-49.48,;-6.87,-50.4,;-5.48,-49.73,;-3.95,-50.63,;-2.67,-49.89,;-1.39,-50.62,;-1.39,-52.11,;-2.67,-52.85,;-3.95,-52.11,;-4.73,-46.97,;-5.51,-45.64,;-3.18,-46.96,;-2.43,-45.61,;-.89,-45.43,;-.58,-43.92,;-1.93,-43.16,;-3.06,-44.21,)|
Show InChI InChI=1S/C20H17N3OS/c1-20(18(24)22-19-23-21-11-25-19)10-16-12-6-2-4-8-14(12)17(20)15-9-5-3-7-13(15)16/h2-9,11,16-17H,10H2,1H3,(H,22,23,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
5.40n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Displacement of FITC-dexamethasone from human recombinant glucocorticoid receptor alpha by fluorescence polarization assay


Bioorg Med Chem Lett 19: 2139-43 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.006
BindingDB Entry DOI: 10.7270/Q2XW4KRC
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(Homo sapiens (Human))
BDBM50249192
PNG
(15-methyl-N-(1,3,4-thiadiazol-2-yl)tetracyclo[6.6....)
Show SMILES CC1(CC2c3ccccc3C1c1ccccc21)C(=O)Nc1nncs1 |TLB:0:1:4.9:11.16,8:9:2.1:11.16,12:11:4.9:2.1,THB:17:1:4.9:11.16,(-6.83,-47.54,;-5.48,-48.31,;-4.97,-49.08,;-4.97,-51.28,;-6.84,-51.8,;-8.18,-52.57,;-9.52,-51.8,;-9.51,-50.25,;-8.19,-49.48,;-6.87,-50.4,;-5.48,-49.73,;-3.95,-50.63,;-2.67,-49.89,;-1.39,-50.62,;-1.39,-52.11,;-2.67,-52.85,;-3.95,-52.11,;-4.73,-46.97,;-5.51,-45.64,;-3.18,-46.96,;-2.43,-45.61,;-.89,-45.43,;-.58,-43.92,;-1.93,-43.16,;-3.06,-44.21,)|
Show InChI InChI=1S/C20H17N3OS/c1-20(18(24)22-19-23-21-11-25-19)10-16-12-6-2-4-8-14(12)17(20)15-9-5-3-7-13(15)16/h2-9,11,16-17H,10H2,1H3,(H,22,23,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 295n/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Transrepression activity at GR in PMA-stimulated human A549 cells assessed as inhibition of AP1 response element-induced luciferase reporter gene act...


Bioorg Med Chem Lett 19: 2139-43 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.006
BindingDB Entry DOI: 10.7270/Q2XW4KRC
More data for this
Ligand-Target Pair