Found 96 hits with Last Name = 'yun' and Initial = 't' 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 |
|---|
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401333
(CHEMBL1230584)Show SMILES COc1c(C)cnc(Cn2cc(C#CCC(C)(C)O)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C21H24ClN5O2/c1-12-9-24-15(13(2)17(12)29-5)11-27-10-14(7-6-8-21(3,4)28)16-18(22)25-20(23)26-19(16)27/h9-10,28H,8,11H2,1-5H3,(H2,23,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| MMDB
Article
PubMed
| 0.200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Binding affinity at recombinant Hsp90alpha incubated for 16 hrs by fluorescence polarization competition assay |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM20800
(2-amino-6-halopurine analogue, 20 | 6-chloro-9-[(4...)Show InChI InChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| 1.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Binding affinity at recombinant Hsp90alpha incubated for 16 hrs by fluorescence polarization competition assay |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Endoplasmin
(Homo sapiens (Human)) | BDBM50401333
(CHEMBL1230584)Show SMILES COc1c(C)cnc(Cn2cc(C#CCC(C)(C)O)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C21H24ClN5O2/c1-12-9-24-15(13(2)17(12)29-5)11-27-10-14(7-6-8-21(3,4)28)16-18(22)25-20(23)26-19(16)27/h9-10,28H,8,11H2,1-5H3,(H2,23,25,26) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| 61 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Binding affinity at Grp94 incubated for 16 hrs by fluorescence polarization competition assay |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein 75 kDa, mitochondrial
(Homo sapiens (Human)) | BDBM50401333
(CHEMBL1230584)Show SMILES COc1c(C)cnc(Cn2cc(C#CCC(C)(C)O)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C21H24ClN5O2/c1-12-9-24-15(13(2)17(12)29-5)11-27-10-14(7-6-8-21(3,4)28)16-18(22)25-20(23)26-19(16)27/h9-10,28H,8,11H2,1-5H3,(H2,23,25,26) | PDB
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| 255 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Binding affinity at TRAP1 incubated for 16 hrs by fluorescence polarization competition assay |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401335
(CHEMBL2205798)Show SMILES COc1c(C)cnc(Cn2cc(C#CCO)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C18H18ClN5O2/c1-10-7-21-13(11(2)15(10)26-3)9-24-8-12(5-4-6-25)14-16(19)22-18(20)23-17(14)24/h7-8,25H,6,9H2,1-3H3,(H2,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401336
(CHEMBL2205245)Show InChI InChI=1S/C17H16ClN5O/c1-5-11-7-23(16-13(11)15(18)21-17(19)22-16)8-12-10(3)14(24-4)9(2)6-20-12/h1,6-7H,8H2,2-4H3,(H2,19,21,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401333
(CHEMBL1230584)Show SMILES COc1c(C)cnc(Cn2cc(C#CCC(C)(C)O)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C21H24ClN5O2/c1-12-9-24-15(13(2)17(12)29-5)11-27-10-14(7-6-8-21(3,4)28)16-18(22)25-20(23)26-19(16)27/h9-10,28H,8,11H2,1-5H3,(H2,23,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Similars
| MMDB
Article
PubMed
| n/a | n/a | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401334
(CHEMBL2205799)Show SMILES COc1c(C)cnc(Cn2cc(C#CCCO)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C19H20ClN5O2/c1-11-8-22-14(12(2)16(11)27-3)10-25-9-13(6-4-5-7-26)15-17(20)23-19(21)24-18(15)25/h8-9,26H,5,7,10H2,1-3H3,(H2,21,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50378702
(CHEMBL560895 | SNX-2112)Show SMILES CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(NC3CCC(O)CC3)c2)C(F)(F)F)C(=O)C1 Show InChI InChI=1S/C23H27F3N4O3/c1-22(2)10-17-19(18(32)11-22)20(23(24,25)26)29-30(17)13-5-8-15(21(27)33)16(9-13)28-12-3-6-14(31)7-4-12/h5,8-9,12,14,28,31H,3-4,6-7,10-11H2,1-2H3,(H2,27,33)/t12-,14- | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401332
(CHEMBL2205800)Show SMILES COc1c(C)cnc(Cn2cc(CCCO)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C18H22ClN5O2/c1-10-7-21-13(11(2)15(10)26-3)9-24-8-12(5-4-6-25)14-16(19)22-18(20)23-17(14)24/h7-8,25H,4-6,9H2,1-3H3,(H2,20,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM20800
(2-amino-6-halopurine analogue, 20 | 6-chloro-9-[(4...)Show InChI InChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 5.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Heat shock protein HSP 90-alpha
(Homo sapiens (Human)) | BDBM50401337
(CHEMBL2205244)Show SMILES COc1c(C)cnc(Cn2cc(-c3ccccc3)c3c(Cl)nc(N)nc23)c1C Show InChI InChI=1S/C21H20ClN5O/c1-12-9-24-16(13(2)18(12)28-3)11-27-10-15(14-7-5-4-6-8-14)17-19(22)25-21(23)26-20(17)27/h4-10H,11H2,1-3H3,(H2,23,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Hsp90alpha |
J Med Chem 55: 7786-95 (2012)
Article DOI: 10.1021/jm300810x
BindingDB Entry DOI: 10.7270/Q2V125Z3 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306906
(((R)-7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropy...)Show SMILES CC1=Nc2ccnn2[C@@H](C1C(=O)N1CCC[C@H]1c1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C24H21Cl2FN4O/c1-14-22(24(32)30-12-2-3-20(30)15-4-7-17(27)8-5-15)23(31-21(29-14)10-11-28-31)16-6-9-18(25)19(26)13-16/h4-11,13,20,22-23H,2-3,12H2,1H3/t20-,22?,23+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306891
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C24H21Cl2FN4O/c1-14-22(24(32)30-12-2-3-20(30)15-4-7-17(27)8-5-15)23(31-21(29-14)10-11-28-31)16-6-9-18(25)19(26)13-16/h4-11,13,20,22-23H,2-3,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306891
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C24H21Cl2FN4O/c1-14-22(24(32)30-12-2-3-20(30)15-4-7-17(27)8-5-15)23(31-21(29-14)10-11-28-31)16-6-9-18(25)19(26)13-16/h4-11,13,20,22-23H,2-3,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306905
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1cc(no1)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:32| Show InChI InChI=1S/C22H21Cl2N5O2/c1-12-10-17(27-31-12)18-4-3-9-28(18)22(30)20-13(2)26-19-7-8-25-29(19)21(20)14-5-6-15(23)16(24)11-14/h5-8,10-11,18,20-21H,3-4,9H2,1-2H3/t18-,20?,21?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306904
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1cc(on1)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:32| Show InChI InChI=1S/C22H21Cl2N5O2/c1-12-10-18(31-27-12)17-4-3-9-28(17)22(30)20-13(2)26-19-7-8-25-29(19)21(20)14-5-6-15(23)16(24)11-14/h5-8,10-11,17,20-21H,3-4,9H2,1-2H3/t17-,20?,21?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306890
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccccc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C24H22Cl2N4O/c1-15-22(24(31)29-13-5-8-20(29)16-6-3-2-4-7-16)23(30-21(28-15)11-12-27-30)17-9-10-18(25)19(26)14-17/h2-4,6-7,9-12,14,20,22-23H,5,8,13H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306893
((2S)-methyl 1-(7-(3,4-dichlorophenyl)-5-methyl-4,7...)Show SMILES COC(=O)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:29| Show InChI InChI=1S/C20H20Cl2N4O3/c1-11-17(19(27)25-9-3-4-15(25)20(28)29-2)18(26-16(24-11)7-8-23-26)12-5-6-13(21)14(22)10-12/h5-8,10,15,17-18H,3-4,9H2,1-2H3/t15-,17?,18?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306892
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCC(C1)c1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C24H21Cl2FN4O/c1-14-22(24(32)30-11-9-17(13-30)15-2-5-18(27)6-3-15)23(31-21(29-14)8-10-28-31)16-4-7-19(25)20(26)12-16/h2-8,10,12,17,22-23H,9,11,13H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306897
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1noc(n1)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:32| Show InChI InChI=1S/C21H20Cl2N6O2/c1-11-18(21(30)28-9-3-4-16(28)20-26-12(2)27-31-20)19(29-17(25-11)7-8-24-29)13-5-6-14(22)15(23)10-13/h5-8,10,16,18-19H,3-4,9H2,1-2H3/t16-,18?,19?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50254778
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES COC[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:28| Show InChI InChI=1S/C20H22Cl2N4O2/c1-12-18(20(27)25-9-3-4-14(25)11-28-2)19(26-17(24-12)7-8-23-26)13-5-6-15(21)16(22)10-13/h5-8,10,14,18-19H,3-4,9,11H2,1-2H3/t14-,18?,19?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306900
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1nc(sc1C)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:33| Show InChI InChI=1S/C23H23Cl2N5OS/c1-12-14(3)32-22(28-12)18-5-4-10-29(18)23(31)20-13(2)27-19-8-9-26-30(19)21(20)15-6-7-16(24)17(25)11-15/h6-9,11,18,20-21H,4-5,10H2,1-3H3/t18-,20?,21?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306894
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccncc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C23H21Cl2N5O/c1-14-21(23(31)29-12-2-3-19(29)15-6-9-26-10-7-15)22(30-20(28-14)8-11-27-30)16-4-5-17(24)18(25)13-16/h4-11,13,19,21-22H,2-3,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 310 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306899
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCC[C@H]1c1nnn(C)n1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C20H20Cl2N8O/c1-11-17(20(31)29-9-3-4-15(29)19-25-27-28(2)26-19)18(30-16(24-11)7-8-23-30)12-5-6-13(21)14(22)10-12/h5-8,10,15,17-18H,3-4,9H2,1-2H3/t15-,17?,18?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50254697
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C18H18Cl2N4O/c1-11-16(18(25)23-8-2-3-9-23)17(24-15(22-11)6-7-21-24)12-4-5-13(19)14(20)10-12/h4-7,10,16-17H,2-3,8-9H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306896
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccccn1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C23H21Cl2N5O/c1-14-21(23(31)29-12-4-6-19(29)18-5-2-3-10-26-18)22(30-20(28-14)9-11-27-30)15-7-8-16(24)17(25)13-15/h2-3,5,7-11,13,19,21-22H,4,6,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 660 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306905
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1cc(no1)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:32| Show InChI InChI=1S/C22H21Cl2N5O2/c1-12-10-17(27-31-12)18-4-3-9-28(18)22(30)20-13(2)26-19-7-8-25-29(19)21(20)14-5-6-15(23)16(24)11-14/h5-8,10-11,18,20-21H,3-4,9H2,1-2H3/t18-,20?,21?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306897
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1noc(n1)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:32| Show InChI InChI=1S/C21H20Cl2N6O2/c1-11-18(21(30)28-9-3-4-16(28)20-26-12(2)27-31-20)19(29-17(25-11)7-8-24-29)13-5-6-14(22)15(23)10-13/h5-8,10,16,18-19H,3-4,9H2,1-2H3/t16-,18?,19?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306895
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1cccnc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C23H21Cl2N5O/c1-14-21(23(31)29-11-3-5-19(29)16-4-2-9-26-13-16)22(30-20(28-14)8-10-27-30)15-6-7-17(24)18(25)12-15/h2,4,6-10,12-13,19,21-22H,3,5,11H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306898
(((S)-2-(1H-tetrazol-5-yl)pyrrolidin-1-yl)(7-(3,4-d...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCC[C@H]1c1nnn[nH]1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C19H18Cl2N8O/c1-10-16(19(30)28-8-2-3-14(28)18-24-26-27-25-18)17(29-15(23-10)6-7-22-29)11-4-5-12(20)13(21)9-11/h4-7,9,14,16-17H,2-3,8H2,1H3,(H,24,25,26,27)/t14-,16?,17?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306904
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES Cc1cc(on1)[C@@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:32| Show InChI InChI=1S/C22H21Cl2N5O2/c1-12-10-18(31-27-12)17-4-3-9-28(17)22(30)20-13(2)26-19-7-8-25-29(19)21(20)14-5-6-15(23)16(24)11-14/h5-8,10-11,17,20-21H,3-4,9H2,1-2H3/t17-,20?,21?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306903
(((S)-2-(5-amino-1,3,4-thiadiazol-2-yl)pyrrolidin-1...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCC[C@H]1c1nnc(N)s1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C20H19Cl2N7OS/c1-10-16(19(30)28-8-2-3-14(28)18-26-27-20(23)31-18)17(29-15(25-10)6-7-24-29)11-4-5-12(21)13(22)9-11/h4-7,9,14,16-17H,2-3,8H2,1H3,(H2,23,27)/t14-,16?,17?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306901
(((S)-2-(4H-1,2,4-triazol-3-yl)pyrrolidin-1-yl)(7-(...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCC[C@H]1c1nnc[nH]1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C20H19Cl2N7O/c1-11-17(20(30)28-8-2-3-15(28)19-23-10-24-27-19)18(29-16(26-11)6-7-25-29)12-4-5-13(21)14(22)9-12/h4-7,9-10,15,17-18H,2-3,8H2,1H3,(H,23,24,27)/t15-,17?,18?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306902
(3-((2S)-1-(7-(3,4-dichlorophenyl)-5-methyl-4,7-dih...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCC[C@H]1c1n[nH]c(=O)n1C)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C21H21Cl2N7O2/c1-11-17(20(31)29-9-3-4-15(29)19-26-27-21(32)28(19)2)18(30-16(25-11)7-8-24-30)12-5-6-13(22)14(23)10-12/h5-8,10,15,17-18H,3-4,9H2,1-2H3,(H,27,32)/t15-,17?,18?/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306889
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES COC[C@H]1CCCN1C(=O)C1C(c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:28| Show InChI InChI=1S/C20H22Cl2N4O2/c1-12-18(20(27)25-9-3-4-14(25)11-28-2)19(26-17(24-12)7-8-23-26)13-5-6-15(21)16(22)10-13/h5-8,10,14,18-19H,3-4,9,11H2,1-2H3/t14-,18?,19?/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306891
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C24H21Cl2FN4O/c1-14-22(24(32)30-12-2-3-20(30)15-4-7-17(27)8-5-15)23(31-21(29-14)10-11-28-31)16-6-9-18(25)19(26)13-16/h4-11,13,20,22-23H,2-3,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117753
(CHEMBL3613806)Show SMILES COc1cc(CNCc2ccc(o2)-c2ccc(Cl)cc2)cc(OC)c1OC Show InChI InChI=1S/C21H22ClNO4/c1-24-19-10-14(11-20(25-2)21(19)26-3)12-23-13-17-8-9-18(27-17)15-4-6-16(22)7-5-15/h4-11,23H,12-13H2,1-3H3 | 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 | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav3.1 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily A member 5
(Homo sapiens (Human)) | BDBM50306891
((7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazo...)Show SMILES CC1=Nc2ccnn2C(C1C(=O)N1CCCC1c1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 |t:1| Show InChI InChI=1S/C24H21Cl2FN4O/c1-14-22(24(32)30-12-2-3-20(30)15-4-7-17(27)8-5-15)23(31-21(29-14)10-11-28-31)16-6-9-18(25)19(26)13-16/h4-11,13,20,22-23H,2-3,12H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells |
Bioorg Med Chem Lett 20: 1436-9 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.085
BindingDB Entry DOI: 10.7270/Q2MG7PM1 |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117754
(CHEMBL3613808)Show SMILES COc1ccc(cc1Cl)-c1ccc(CNCc2cc(OC)c(OC)c(OC)c2)o1 Show InChI InChI=1S/C22H24ClNO5/c1-25-19-7-5-15(11-17(19)23)18-8-6-16(29-18)13-24-12-14-9-20(26-2)22(28-4)21(10-14)27-3/h5-11,24H,12-13H2,1-4H3 | 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 | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav3.1 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117752
(CHEMBL3613804)Show SMILES COc1cc(CNCc2ccc(o2)-c2cccc(c2)C(F)(F)F)cc(OC)c1OC Show InChI InChI=1S/C22H22F3NO4/c1-27-19-9-14(10-20(28-2)21(19)29-3)12-26-13-17-7-8-18(30-17)15-5-4-6-16(11-15)22(23,24)25/h4-11,26H,12-13H2,1-3H3 | 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 | 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav3.1 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent N-type calcium channel subunit alpha-1B
(Homo sapiens (Human)) | BDBM50117753
(CHEMBL3613806)Show SMILES COc1cc(CNCc2ccc(o2)-c2ccc(Cl)cc2)cc(OC)c1OC Show InChI InChI=1S/C21H22ClNO4/c1-24-19-10-14(11-20(25-2)21(19)26-3)12-23-13-17-8-9-18(27-17)15-4-6-16(22)7-5-15/h4-11,23H,12-13H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav2.2 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117756
(CHEMBL3613811)Show InChI InChI=1S/C19H21ClN2O3/c1-23-17-6-12(7-18(24-2)19(17)25-3)9-21-10-13-11-22-16-5-4-14(20)8-15(13)16/h4-8,11,21-22H,9-10H2,1-3H3 | 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 | 5.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav3.1 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent N-type calcium channel subunit alpha-1B
(Homo sapiens (Human)) | BDBM50117754
(CHEMBL3613808)Show SMILES COc1ccc(cc1Cl)-c1ccc(CNCc2cc(OC)c(OC)c(OC)c2)o1 Show InChI InChI=1S/C22H24ClNO5/c1-25-19-7-5-15(11-17(19)23)18-8-6-16(29-18)13-24-12-14-9-20(26-2)22(28-4)21(10-14)27-3/h5-11,24H,12-13H2,1-4H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav2.2 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117755
(CHEMBL3613810)Show SMILES COc1cc(CNCc2ccc(Oc3ccc(cc3)C#N)cc2)cc(OC)c1OC Show InChI InChI=1S/C24H24N2O4/c1-27-22-12-19(13-23(28-2)24(22)29-3)16-26-15-18-6-10-21(11-7-18)30-20-8-4-17(14-25)5-9-20/h4-13,26H,15-16H2,1-3H3 | 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 | 6.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav3.1 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent N-type calcium channel subunit alpha-1B
(Homo sapiens (Human)) | BDBM50117752
(CHEMBL3613804)Show SMILES COc1cc(CNCc2ccc(o2)-c2cccc(c2)C(F)(F)F)cc(OC)c1OC Show InChI InChI=1S/C22H22F3NO4/c1-27-19-9-14(10-20(28-2)21(19)29-3)12-26-13-17-7-8-18(30-17)15-5-4-6-16(11-15)22(23,24)25/h4-11,26H,12-13H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav2.2 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117751
(CHEMBL3613802)Show SMILES NC(=O)c1cccc(NCc2ccc(o2)-c2ccc(Oc3ccc(cc3)C#N)cc2)c1 Show InChI InChI=1S/C25H19N3O3/c26-15-17-4-8-21(9-5-17)30-22-10-6-18(7-11-22)24-13-12-23(31-24)16-28-20-3-1-2-19(14-20)25(27)29/h1-14,28H,16H2,(H2,27,29) | 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 | 7.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav3.1 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent N-type calcium channel subunit alpha-1B
(Homo sapiens (Human)) | BDBM50117755
(CHEMBL3613810)Show SMILES COc1cc(CNCc2ccc(Oc3ccc(cc3)C#N)cc2)cc(OC)c1OC Show InChI InChI=1S/C24H24N2O4/c1-27-22-12-19(13-23(28-2)24(22)29-3)16-26-15-18-6-10-21(11-7-18)30-20-8-4-17(14-25)5-9-20/h4-13,26H,15-16H2,1-3H3 | PDB
UniProtKB/SwissProt
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 |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav2.2 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Voltage-dependent N-type calcium channel subunit alpha-1B
(Homo sapiens (Human)) | BDBM50117756
(CHEMBL3613811)Show InChI InChI=1S/C19H21ClN2O3/c1-23-17-6-12(7-18(24-2)19(17)25-3)9-21-10-13-11-22-16-5-4-14(20)8-15(13)16/h4-8,11,21-22H,9-10H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Ewha Womans University
Curated by ChEMBL
| Assay Description
Inhibition of Cav2.2 channel (unknown origin) assessed as reduction in peak currents by whole cell patch-clamp method |
Bioorg Med Chem 23: 6166-72 (2015)
Article DOI: 10.1016/j.bmc.2015.07.067
BindingDB Entry DOI: 10.7270/Q21R6S9B |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase PLK1
(Homo sapiens (Human)) | BDBM50206448
(CHEMBL3944542)Show SMILES CC(C)C1=C\C(=N\OC(=O)c2ccccc2C)C(C)=CC1=O |c:19,t:3| Show InChI InChI=1S/C18H19NO3/c1-11(2)15-10-16(13(4)9-17(15)20)19-22-18(21)14-8-6-5-7-12(14)3/h5-11H,1-4H3/b19-16- | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.94E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Peking University
Curated by ChEMBL
| Assay Description
Inhibition of 5-FAM-DPPLHSpTAI-OH binding to PLK1 polo-box domain (unknown origin) expressed in Escherichia coli Rosetta (DE3) after 1 hr by fluoresc... |
Eur J Med Chem 124: 229-236 (2016)
Article DOI: 10.1016/j.ejmech.2016.08.043
BindingDB Entry DOI: 10.7270/Q22F7QFW |
More data for this
Ligand-Target Pair | |
Search and Browse
