BindingDB logo
myBDB logout

BDBM50091955 3-(2-Diethylamino-ethoxy)-5a,11a-dihydro-benzo[b]naphtho[2,3-d]furan-6,11-dione::CHEMBL292475

SMILES: CCN(CC)CCOc1ccc2c(c1)oc1c(O)c3ccccc3c(O)c21

InChI Key: InChIKey=RLDUSFODMUWPNX-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50091955   
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
Telomerase reverse transcriptase


(Homo sapiens (Human))
BDBM50091955
PNG
(3-(2-Diethylamino-ethoxy)-5a,11a-dihydro-benzo[b]n...)
Show SMILES CCN(CC)CCOc1ccc2c(c1)oc1c(O)c3ccccc3c(O)c21
Show InChI InChI=1S/C22H23NO4/c1-3-23(4-2)11-12-26-14-9-10-17-18(13-14)27-22-19(17)20(24)15-7-5-6-8-16(15)21(22)25/h5-10,13,24-25H,3-4,11-12H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 6.92E+9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of telomerase (unknown origin)


Citation and Details

Article DOI: 10.1007/s00044-011-9594-4
BindingDB Entry DOI: 10.7270/Q2X63QV3
More data for this
Ligand-Target Pair
Telomerase reverse transcriptase


(Homo sapiens (Human))
BDBM50091955
PNG
(3-(2-Diethylamino-ethoxy)-5a,11a-dihydro-benzo[b]n...)
Show SMILES CCN(CC)CCOc1ccc2c(c1)oc1c(O)c3ccccc3c(O)c21
Show InChI InChI=1S/C22H23NO4/c1-3-23(4-2)11-12-26-14-9-10-17-18(13-14)27-22-19(17)20(24)15-7-5-6-8-16(15)21(22)25/h5-10,13,24-25H,3-4,11-12H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 7.00E+3n/an/an/an/an/an/a



Reading University

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound was tested against human ovarian cancer cell (A2780 cells) Telomerase


Bioorg Med Chem Lett 10: 2063-6 (2000)


BindingDB Entry DOI: 10.7270/Q25T3JQM
More data for this
Ligand-Target Pair