Found 13 hits Enz. Inhib. hit(s) with all data for entry = 50036647 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50005746
(CHEMBL109382 | CHEMBL33618 | N-[9,10-Dioxo-6-(3-pi...)Show SMILES O=C(CCN1CCCCC1)Nc1ccc2C(=O)c3cc(NC(=O)CCN4CCCCC4)ccc3C(=O)c2c1 Show InChI InChI=1S/C30H36N4O4/c35-27(11-17-33-13-3-1-4-14-33)31-21-7-9-23-25(19-21)29(37)24-10-8-22(20-26(24)30(23)38)32-28(36)12-18-34-15-5-2-6-16-34/h7-10,19-20H,1-6,11-18H2,(H,31,35)(H,32,36) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50369390
(CHEMBL54224)Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1CC[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O1 |r| Show InChI InChI=1S/C10H16N5O12P3/c11-10-13-8-7(9(16)14-10)12-4-15(8)6-2-1-5(25-6)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h4-6H,1-3H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,11,13,14,16)/t5-,6+/m0/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Concentration required to inhibit telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066353
(3-(2-Hydroxymethyl-1-methyl-piperidinium-1-yl)-N-{...)Show SMILES C[N+]1(CCC(=O)Nc2ccc(NC(=O)CC[N+]3(C)CCCCC3CO)c3C(=O)c4ccccc4C(=O)c23)CCCCC1CO Show InChI InChI=1S/C34H44N4O6/c1-37(17-7-5-9-23(37)21-39)19-15-29(41)35-27-13-14-28(32-31(27)33(43)25-11-3-4-12-26(25)34(32)44)36-30(42)16-20-38(2)18-8-6-10-24(38)22-40/h3-4,11-14,23-24,39-40H,5-10,15-22H2,1-2H3/p+2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066357
(3-(1-Methyl-piperidinium-1-yl)-N-{4-[3-(1-methyl-p...)Show SMILES C[N+]1(CCC(=O)Nc2ccc(NC(=O)CC[N+]3(C)CCCCC3)c3C(=O)c4ccccc4C(=O)c23)CCCCC1 Show InChI InChI=1S/C32H40N4O4/c1-35(17-7-3-8-18-35)21-15-27(37)33-25-13-14-26(34-28(38)16-22-36(2)19-9-4-10-20-36)30-29(25)31(39)23-11-5-6-12-24(23)32(30)40/h5-6,11-14H,3-4,7-10,15-22H2,1-2H3/p+2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066361
(3-[4-(2-Hydroxy-ethyl)-piperazin-1-yl]-N-(6-{3-[4-...)Show SMILES OCCN1CCN(CCC(=O)Nc2ccc3C(=O)c4cc(NC(=O)CCN5CCN(CCO)CC5)ccc4C(=O)c3c2)CC1 Show InChI InChI=1S/C32H42N6O6/c39-19-17-37-13-9-35(10-14-37)7-5-29(41)33-23-1-3-25-27(21-23)32(44)26-4-2-24(22-28(26)31(25)43)34-30(42)6-8-36-11-15-38(16-12-36)18-20-40/h1-4,21-22,39-40H,5-20H2,(H,33,41)(H,34,42) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.65E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066345
(3-Trimethylammonium-N-[6-(3-dimethylammonium-propi...)Show SMILES C[N+](C)(C)CCC(=O)Nc1ccc2C(=O)c3cc(NC(=O)CC[N+](C)(C)C)ccc3C(=O)c2c1 Show InChI InChI=1S/C26H32N4O4/c1-29(2,3)13-11-23(31)27-17-7-9-19-21(15-17)25(33)20-10-8-18(16-22(20)26(19)34)28-24(32)12-14-30(4,5)6/h7-10,15-16H,11-14H2,1-6H3/p+2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066350
(3-Morpholin-4-yl-N-[4-(3-morpholin-4-yl-propionyla...)Show SMILES O=C(CCN1CCOCC1)Nc1ccc(NC(=O)CCN2CCOCC2)c2C(=O)c3ccccc3C(=O)c12 Show InChI InChI=1S/C28H32N4O6/c33-23(7-9-31-11-15-37-16-12-31)29-21-5-6-22(30-24(34)8-10-32-13-17-38-18-14-32)26-25(21)27(35)19-3-1-2-4-20(19)28(26)36/h1-6H,7-18H2,(H,29,33)(H,30,34) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.35E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066352
(3-(4-Methyl-morpholinium-4-yl)-N-{4-[3-(4-methyl-m...)Show SMILES C[N+]1(CCC(=O)Nc2ccc(NC(=O)CC[N+]3(C)CCOCC3)c3C(=O)c4ccccc4C(=O)c23)CCOCC1 Show InChI InChI=1S/C30H36N4O6/c1-33(13-17-39-18-14-33)11-9-25(35)31-23-7-8-24(32-26(36)10-12-34(2)15-19-40-20-16-34)28-27(23)29(37)21-5-3-4-6-22(21)30(28)38/h3-8H,9-20H2,1-2H3/p+2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.45E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066363
(3-Dipropylamino-N-[6-(3-dipropylamino-propionylami...)Show SMILES CCCN(CCC)CCC(=O)Nc1ccc2C(=O)c3cc(NC(=O)CCN(CCC)CCC)ccc3C(=O)c2c1 Show InChI InChI=1S/C32H44N4O4/c1-5-15-35(16-6-2)19-13-29(37)33-23-9-11-25-27(21-23)31(39)26-12-10-24(22-28(26)32(25)40)34-30(38)14-20-36(17-7-3)18-8-4/h9-12,21-22H,5-8,13-20H2,1-4H3,(H,33,37)(H,34,38) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066368
(CHEMBL419381 | N-[9,10-Dioxo-6-(2-piperidin-1-yl-a...)Show SMILES O=C(CN1CCCCC1)Nc1ccc2C(=O)c3cc(NC(=O)CN4CCCCC4)ccc3C(=O)c2c1 Show InChI InChI=1S/C28H32N4O4/c33-25(17-31-11-3-1-4-12-31)29-19-7-9-21-23(15-19)27(35)22-10-8-20(16-24(22)28(21)36)30-26(34)18-32-13-5-2-6-14-32/h7-10,15-16H,1-6,11-14,17-18H2,(H,29,33)(H,30,34) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066347
(2-Morpholin-4-yl-N-[6-(2-morpholin-4-yl-acetylamin...)Show SMILES O=C(CN1CCOCC1)Nc1ccc2C(=O)c3cc(NC(=O)CN4CCOCC4)ccc3C(=O)c2c1 Show InChI InChI=1S/C26H28N4O6/c31-23(15-29-5-9-35-10-6-29)27-17-1-3-19-21(13-17)26(34)20-4-2-18(14-22(20)25(19)33)28-24(32)16-30-7-11-36-12-8-30/h1-4,13-14H,5-12,15-16H2,(H,27,31)(H,28,32) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50066365
(3-Dipropylamino-N-[4-(3-dipropylamino-propionylami...)Show SMILES CCCN(CCC)CCC(=O)Nc1ccc(NC(=O)CCN(CCC)CCC)c2C(=O)c3ccccc3C(=O)c12 Show InChI InChI=1S/C32H44N4O4/c1-5-17-35(18-6-2)21-15-27(37)33-25-13-14-26(34-28(38)16-22-36(19-7-3)20-8-4)30-29(25)31(39)23-11-9-10-12-24(23)32(30)40/h9-14H,5-8,15-22H2,1-4H3,(H,33,37)(H,34,38) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
Telomerase reverse transcriptase
(Homo sapiens (Human)) | BDBM50005756
(3-Morpholin-4-yl-N-[6-(3-morpholin-4-yl-propionyla...)Show SMILES O=C(CCN1CCOCC1)Nc1ccc2C(=O)c3cc(NC(=O)CCN4CCOCC4)ccc3C(=O)c2c1 Show InChI InChI=1S/C28H32N4O6/c33-25(5-7-31-9-13-37-14-10-31)29-19-1-3-21-23(17-19)28(36)22-4-2-20(18-24(22)27(21)35)30-26(34)6-8-32-11-15-38-16-12-32/h1-4,17-18H,5-16H2,(H,29,33)(H,30,34) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research
Curated by ChEMBL
| Assay Description
Inhibition of telomerase activity |
J Med Chem 41: 3253-60 (1998)
Article DOI: 10.1021/jm9801105
BindingDB Entry DOI: 10.7270/Q2TX3G1R |
More data for this
Ligand-Target Pair | |
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