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PubMed code 23974014

Compile data set for download or QSAR
Found 16 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50310892
PNG
(CHEMBL1078511 | N,N'-(9-(2-(1-methylpyrrolidin-2-y...)
Show SMILES CN1CCCC1CCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12
Show InChI InChI=1S/C34H47N7O2/c1-39-16-6-7-27(39)12-15-35-34-28-10-8-25(36-32(42)13-21-40-17-2-3-18-40)23-30(28)38-31-24-26(9-11-29(31)34)37-33(43)14-22-41-19-4-5-20-41/h8-11,23-24,27H,2-7,12-22H2,1H3,(H,35,38)(H,36,42)(H,37,43)
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n/an/a 18n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440391
PNG
(CHEMBL2425367)
Show SMILES CN(C)CCCNCc1ccc2nc3c(ccc4nc5ccc(CNCCCN(C)C)cc5cc34)cc2c1
Show InChI InChI=1S/C32H40N6/c1-37(2)15-5-13-33-21-23-8-11-30-26(17-23)19-25-9-12-31-28(32(25)36-30)20-27-18-24(7-10-29(27)35-31)22-34-14-6-16-38(3)4/h7-12,17-20,33-34H,5-6,13-16,21-22H2,1-4H3
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n/an/a 28n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50134018
PNG
(CHEMBL335819 | N,N'-(9-(4-aminophenylamino)acridin...)
Show SMILES Nc1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)cc1
Show InChI InChI=1S/C33H39N7O2/c34-23-5-7-24(8-6-23)37-33-27-11-9-25(35-31(41)13-19-39-15-1-2-16-39)21-29(27)38-30-22-26(10-12-28(30)33)36-32(42)14-20-40-17-3-4-18-40/h5-12,21-22H,1-4,13-20,34H2,(H,35,41)(H,36,42)(H,37,38)
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n/an/a 60n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440389
PNG
(CHEMBL1997011)
Show SMILES CCNCC(=O)Nc1ccc2C(=O)c3cc(NC(=O)CNCC)ccc3C(=O)c2c1
Show InChI InChI=1S/C22H24N4O4/c1-3-23-11-19(27)25-13-5-7-15-17(9-13)21(29)16-8-6-14(10-18(16)22(15)30)26-20(28)12-24-4-2/h5-10,23-24H,3-4,11-12H2,1-2H3,(H,25,27)(H,26,28)
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n/an/a 100n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440390
PNG
(ISOMETAMIDIUM)
Show SMILES CCn1c(-c2ccccc2)c2cc(NN=Nc3cccc(c3)C(N)=N)ccc2c2ccc(=[NH2+])cc12
Show InChI InChI=1S/C28H25N7/c1-2-35-26-16-20(29)11-13-24(26)23-14-12-22(17-25(23)27(35)18-7-4-3-5-8-18)33-34-32-21-10-6-9-19(15-21)28(30)31/h3-17,29H,2H2,1H3,(H3,30,31)(H,32,33)/p+1
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n/an/a 100n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440388
PNG
(CHEMBL2425366)
Show SMILES C1CNCc2ccc3nc4c(ccc5cc6cc(CNCCNCCNCc7ccc8nc9c(ccc%10cc%11cc(CNCCN1)ccc%11nc9%10)cc8c7)ccc6nc45)cc3c2
Show InChI InChI=1S/C52H50N10/c1-9-45-41-21-33(1)29-55-17-13-53-14-18-56-30-35-3-11-47-43(23-35)27-39-7-8-40-28-44-24-36(4-12-48(44)62-52(40)51(39)61-47)32-58-20-16-54-15-19-57-31-34-2-10-46-42(22-34)26-38-6-5-37(25-41)49(59-45)50(38)60-46/h1-12,21-28,53-58H,13-20,29-32H2
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n/an/a 130n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440387
PNG
(CHEMBL2425365)
Show SMILES Cc1cc(=[N+](C)C)c2cc(NC(=O)c3cccc(n3)C(=O)Nc3ccc4[n+](C)cccc4c3)ccc2n1C
Show InChI InChI=1S/C30H28N6O2/c1-19-16-28(34(2)3)23-18-22(12-14-27(23)36(19)5)32-30(38)25-10-6-9-24(33-25)29(37)31-21-11-13-26-20(17-21)8-7-15-35(26)4/h6-18H,1-5H3/p+2
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n/an/a 220n/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
Telomerase reverse transcriptase


(Homo sapiens)
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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50111322
PNG
(CHEMBL274335 | N,N-Dimethyl-N'-(11-nitro-13H-5,13-...)
Show SMILES CN(C)CCCNc1nc2ccccc2c2[nH]c3c(ccc4ccc(cc34)[N+]([O-])=O)c12
Show InChI InChI=1S/C24H23N5O2/c1-28(2)13-5-12-25-24-21-18-11-9-15-8-10-16(29(30)31)14-19(15)22(18)27-23(21)17-6-3-4-7-20(17)26-24/h3-4,6-11,14,27H,5,12-13H2,1-2H3,(H,25,26)
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n/an/a 500n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440386
PNG
(CHEMBL2425364)
Show SMILES C1CNCc2ccc3nc4ccc(CNCCNCCNCc5ccc6nc7ccc(CNCCN1)cc7cc6c5)cc4cc3c2
Show InChI InChI=1S/C38H44N8/c1-5-35-31-17-27(1)23-41-13-9-39-10-14-42-25-29-3-7-37-33(19-29)22-34-20-30(4-8-38(34)46-37)26-44-16-12-40-11-15-43-24-28-2-6-36(45-35)32(18-28)21-31/h1-8,17-22,39-44H,9-16,23-26H2
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n/an/a 750n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440385
PNG
(CHEMBL2425363)
Show SMILES Cc1cc[n+](CCC(=O)Nc2ccc3nc4ccc(NC(=O)CC[n+]5ccc(C)cc5)cc4cc3c2)cc1
Show InChI InChI=1S/C31H29N5O2/c1-22-7-13-35(14-8-22)17-11-30(37)32-26-3-5-28-24(20-26)19-25-21-27(4-6-29(25)34-28)33-31(38)12-18-36-15-9-23(2)10-16-36/h3-10,13-16,19-21H,11-12,17-18H2,1-2H3/p+2
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n/an/a 1.30E+3n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50068304
PNG
(CHEMBL343445 | N-[9,10-Dioxo-6-(3-pyrrolidin-1-yl-...)
Show SMILES O=C(CCN1CCCC1)Nc1ccc2C(=O)c3cc(NC(=O)CCN4CCCC4)ccc3C(=O)c2c1
Show InChI InChI=1S/C28H32N4O4/c33-25(9-15-31-11-1-2-12-31)29-19-5-7-21-23(17-19)27(35)22-8-6-20(18-24(22)28(21)36)30-26(34)10-16-32-13-3-4-14-32/h5-8,17-18H,1-4,9-16H2,(H,29,33)(H,30,34)
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n/an/a 1.80E+3n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440384
PNG
(CHEMBL2425362)
Show SMILES C[N+](C)(C)CCOc1ccc2c3c(oc2c1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C21H20NO4/c1-22(2,3)10-11-25-13-8-9-16-17(12-13)26-21-18(16)19(23)14-6-4-5-7-15(14)20(21)24/h4-9,12H,10-11H2,1-3H3/q+1
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n/an/a 5.40E+3n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50412201
PNG
(CRYPTOLEPINE | CRYPTOLEPINE HYDROCHLORIDE | Crypto...)
Show SMILES Cn1c2c(cc3ccccc13)nc1ccccc21
Show InChI InChI=1S/C16H12N2/c1-18-15-9-5-2-6-11(15)10-14-16(18)12-7-3-4-8-13(12)17-14/h2-10H,1H3
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n/an/a 9.40E+3n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440382
PNG
(CHEMBL2425361)
Show SMILES CCN(CC)CCNc1cccc2C(=O)c3cccc(NCCCCCO)c3C(=O)c12
Show InChI InChI=1S/C25H33N3O3/c1-3-28(4-2)16-15-27-21-13-9-11-19-23(21)25(31)22-18(24(19)30)10-8-12-20(22)26-14-6-5-7-17-29/h8-13,26-27,29H,3-7,14-17H2,1-2H3
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n/an/a 1.00E+4n/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
Telomerase reverse transcriptase


(Homo sapiens)
BDBM50440381
PNG
(MERIDINE)
Show SMILES Oc1ccnc2C(=O)c3nccc4c5ccccc5nc(-c12)c34
Show InChI InChI=1S/C18H9N3O2/c22-12-6-8-20-17-14(12)15-13-10(5-7-19-16(13)18(17)23)9-3-1-2-4-11(9)21-15/h1-8H,(H,20,22)
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n/an/a 1.10E+4n/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
* indicates data uncertainty>20%