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3 similar compounds to monomer 50176903

Compile data set for download or QSAR
Wt: 318.4
BDBM50176906
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Wt: 321.4
BDBM50176908

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50176906,50176908   
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))
BDBM50176906
PNG
(CHEMBL219728 | N'-(10H-indolo[3,2-b]quinolin-11-yl...)
Show SMILES CN(C)CCCNc1c2[nH]c3ccccc3c2nc2ccccc12
Show InChI InChI=1S/C20H22N4/c1-24(2)13-7-12-21-18-14-8-3-5-10-16(14)22-19-15-9-4-6-11-17(15)23-20(18)19/h3-6,8-11,23H,7,12-13H2,1-2H3,(H,21,22)
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PC cid
PC sid
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Article
PubMed
n/an/a 630n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of telomerase in human MCF7 cells by cell-free telomerase repeat amplification protocol assay


J Med Chem 51: 6381-92 (2008)


Article DOI: 10.1021/jm800497p
BindingDB Entry DOI: 10.7270/Q2319VQ2
More data for this
Ligand-Target Pair
Telomerase reverse transcriptase


(Homo sapiens (Human))
BDBM50176906
PNG
(CHEMBL219728 | N'-(10H-indolo[3,2-b]quinolin-11-yl...)
Show SMILES CN(C)CCCNc1c2[nH]c3ccccc3c2nc2ccccc12
Show InChI InChI=1S/C20H22N4/c1-24(2)13-7-12-21-18-14-8-3-5-10-16(14)22-19-15-9-4-6-11-17(15)23-20(18)19/h3-6,8-11,23H,7,12-13H2,1-2H3,(H,21,22)
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n/an/a 440n/an/an/an/an/an/a



Universit£ degli Studi"Magna Gr£cia"

Curated by ChEMBL


Assay Description
Inhibition of telomerase (unknown origin) by TRAP assay


Eur J Med Chem 68: 139-49 (2013)


Article DOI: 10.1016/j.ejmech.2013.07.022
BindingDB Entry DOI: 10.7270/Q24J0GJB
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (Human))
BDBM50176908
PNG
(CHEMBL3814075)
Show SMILES CC(C)(C)OC(=O)NCCCCCC(=O)NCc1cccnc1
Show InChI InChI=1S/C17H27N3O3/c1-17(2,3)23-16(22)19-11-6-4-5-9-15(21)20-13-14-8-7-10-18-12-14/h7-8,10,12H,4-6,9,11,13H2,1-3H3,(H,19,22)(H,20,21)
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n/an/an/a 1.05E+5n/an/an/an/an/a



University of California-Irvine

Curated by ChEMBL


Assay Description
Binding affinity to C-terminal four-histidine tagged human CYP3A4delta3 to 24 residues expressed in Escherichia coli assessed as spectral dissociatio...


J Med Chem 59: 4210-20 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01146
BindingDB Entry DOI: 10.7270/Q2Q52RKB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cytochrome P450 3A


(Homo sapiens (Human))
BDBM50176908
PNG
(CHEMBL3814075)
Show SMILES CC(C)(C)OC(=O)NCCCCCC(=O)NCc1cccnc1
Show InChI InChI=1S/C17H27N3O3/c1-17(2,3)23-16(22)19-11-6-4-5-9-15(21)20-13-14-8-7-10-18-12-14/h7-8,10,12H,4-6,9,11,13H2,1-3H3,(H,19,22)(H,20,21)
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n/an/a 7.50E+4n/an/an/an/an/an/a



University of California-Irvine

Curated by ChEMBL


Assay Description
Inhibition of C-terminal four-histidine tagged human CYP3A4delta3 to 24 residues expressed in Escherichia coli assessed as 7-benzyloxy-4-(trifluorome...


J Med Chem 59: 4210-20 (2016)


Article DOI: 10.1021/acs.jmedchem.5b01146
BindingDB Entry DOI: 10.7270/Q2Q52RKB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)