Found 16 hits of Enzyme Inhibition Constant Data 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 |
|---|
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334153
(CHEMBL1645164 | methyl 2-((4-(3-(4-bromophenyl)-3-...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccc(F)cc2)c2ccc(Br)cc2)n1 Show InChI InChI=1S/C25H25BrFN3O4/c1-33-25(32)22-16-34-23(28-22)15-29-10-12-30(13-11-29)24(31)14-21(17-2-6-19(26)7-3-17)18-4-8-20(27)9-5-18/h2-9,16,21H,10-15H2,1H3 | 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 | 860 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50334157
(3-(4-methoxyphenyl)-1-(4-((6-methylbenzo[d]oxazol-...)Show SMILES COc1ccc(cc1)C(CC(=O)N1CCN(Cc2nc3ccc(C)cc3o2)CC1)c1ccccc1 Show InChI InChI=1S/C29H31N3O3/c1-21-8-13-26-27(18-21)35-28(30-26)20-31-14-16-32(17-15-31)29(33)19-25(22-6-4-3-5-7-22)23-9-11-24(34-2)12-10-23/h3-13,18,25H,14-17,19-20H2,1-2H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334156
(3-(4-fluorophenyl)-1-(4-((6-methylbenzo[d]oxazol-2...)Show SMILES Cc1ccc2nc(CN3CCN(CC3)C(=O)CC(c3ccccc3)c3ccc(F)cc3)oc2c1 Show InChI InChI=1S/C28H28FN3O2/c1-20-7-12-25-26(17-20)34-27(30-25)19-31-13-15-32(16-14-31)28(33)18-24(21-5-3-2-4-6-21)22-8-10-23(29)11-9-22/h2-12,17,24H,13-16,18-19H2,1H3 | 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 | 1.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50117922
((1S,2S)-2-(2-((3-(1H-benzo[d]imidazol-2-yl)propyl)...)Show SMILES COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc2cc(F)ccc2[C@@H]1C(C)C |r| Show InChI InChI=1S/C29H38FN3O3/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32)/t28-,29-/m0/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50117922
((1S,2S)-2-(2-((3-(1H-benzo[d]imidazol-2-yl)propyl)...)Show SMILES COCC(=O)O[C@]1(CCN(C)CCCc2nc3ccccc3[nH]2)CCc2cc(F)ccc2[C@@H]1C(C)C |r| Show InChI InChI=1S/C29H38FN3O3/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32)/t28-,29-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334155
(CHEMBL1645167 | methyl 2-((4-(3-(4-fluorophenyl)-3...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccc(F)cc2)c2ccc(cc2)C(F)(F)F)n1 Show InChI InChI=1S/C26H25F4N3O4/c1-36-25(35)22-16-37-23(31-22)15-32-10-12-33(13-11-32)24(34)14-21(18-4-8-20(27)9-5-18)17-2-6-19(7-3-17)26(28,29)30/h2-9,16,21H,10-15H2,1H3 | 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+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50334153
(CHEMBL1645164 | methyl 2-((4-(3-(4-bromophenyl)-3-...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccc(F)cc2)c2ccc(Br)cc2)n1 Show InChI InChI=1S/C25H25BrFN3O4/c1-33-25(32)22-16-34-23(28-22)15-29-10-12-30(13-11-29)24(31)14-21(17-2-6-19(26)7-3-17)18-4-8-20(27)9-5-18/h2-9,16,21H,10-15H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.23E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50334156
(3-(4-fluorophenyl)-1-(4-((6-methylbenzo[d]oxazol-2...)Show SMILES Cc1ccc2nc(CN3CCN(CC3)C(=O)CC(c3ccccc3)c3ccc(F)cc3)oc2c1 Show InChI InChI=1S/C28H28FN3O2/c1-20-7-12-25-26(17-20)34-27(30-25)19-31-13-15-32(16-14-31)28(33)18-24(21-5-3-2-4-6-21)22-8-10-23(29)11-9-22/h2-12,17,24H,13-16,18-19H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334157
(3-(4-methoxyphenyl)-1-(4-((6-methylbenzo[d]oxazol-...)Show SMILES COc1ccc(cc1)C(CC(=O)N1CCN(Cc2nc3ccc(C)cc3o2)CC1)c1ccccc1 Show InChI InChI=1S/C29H31N3O3/c1-21-8-13-26-27(18-21)35-28(30-26)20-31-14-16-32(17-15-31)29(33)19-25(22-6-4-3-5-7-22)23-9-11-24(34-2)12-10-23/h3-13,18,25H,14-17,19-20H2,1-2H3 | 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 | 2.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50334155
(CHEMBL1645167 | methyl 2-((4-(3-(4-fluorophenyl)-3...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccc(F)cc2)c2ccc(cc2)C(F)(F)F)n1 Show InChI InChI=1S/C26H25F4N3O4/c1-36-25(35)22-16-37-23(31-22)15-32-10-12-33(13-11-32)24(34)14-21(18-4-8-20(27)9-5-18)17-2-6-19(7-3-17)26(28,29)30/h2-9,16,21H,10-15H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334151
(CHEMBL1645161 | methyl 2-((4-(3-(4-chlorophenyl)-3...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccc(F)cc2)c2ccc(Cl)cc2)n1 Show InChI InChI=1S/C25H25ClFN3O4/c1-33-25(32)22-16-34-23(28-22)15-29-10-12-30(13-11-29)24(31)14-21(17-2-6-19(26)7-3-17)18-4-8-20(27)9-5-18/h2-9,16,21H,10-15H2,1H3 | 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 | 8.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334154
(CHEMBL1645166 | methyl 2-((4-(3-phenyl-3-(4-(trifl...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccccc2)c2ccc(cc2)C(F)(F)F)n1 Show InChI InChI=1S/C26H26F3N3O4/c1-35-25(34)22-17-36-23(30-22)16-31-11-13-32(14-12-31)24(33)15-21(18-5-3-2-4-6-18)19-7-9-20(10-8-19)26(27,28)29/h2-10,17,21H,11-16H2,1H3 | 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 | 1.71E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334152
(CHEMBL1645163 | methyl 2-((4-(3-(4-bromophenyl)-3-...)Show SMILES COC(=O)c1coc(CN2CCN(CC2)C(=O)CC(c2ccccc2)c2ccc(Br)cc2)n1 Show InChI InChI=1S/C25H26BrN3O4/c1-32-25(31)22-17-33-23(27-22)16-28-11-13-29(14-12-28)24(30)15-21(18-5-3-2-4-6-18)19-7-9-20(26)10-8-19/h2-10,17,21H,11-16H2,1H3 | 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 | 2.12E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel expressed in HEK293 cells assessed as Kcl-induced depolarizaion |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50017702
(1-(bis(4-fluorophenyl)methyl)-4-cinnamylpiperazine...)Show SMILES Fc1ccc(cc1)C(N1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C26H26F2N2/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21/h1-15,26H,16-20H2/b7-4+ | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| n/a | n/a | n/a | 530 | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Binding affinity to T-type alpha1G calcium channel |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1I
(Homo sapiens (Human)) | BDBM50017702
(1-(bis(4-fluorophenyl)methyl)-4-cinnamylpiperazine...)Show SMILES Fc1ccc(cc1)C(N1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C26H26F2N2/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21/h1-15,26H,16-20H2/b7-4+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| n/a | n/a | n/a | 840 | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Binding affinity to T-type alpha1I calcium channel |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
Voltage-dependent T-type calcium channel subunit alpha-1G
(Homo sapiens (Human)) | BDBM50334150
(1-(1-(4,4-bis(4-fluorophenyl)butyl)piperidin-4-yl)...)Show SMILES Fc1ccc(cc1)C(CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(F)cc1 Show InChI InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a |
Institute of Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of T-type alpha1G calcium channel |
Bioorg Med Chem Lett 21: 215-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.033
BindingDB Entry DOI: 10.7270/Q2765FKR |
More data for this
Ligand-Target Pair | |
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