Found 61 hits with Last Name = 'lavrador-erb' and Initial = 'k' 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 |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50297861
(1-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)-N-...)Show SMILES CN(CC1CCOCC1)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(F)cc1 Show InChI InChI=1S/C26H33FN4O/c1-29(18-21-12-16-32-17-13-21)23-10-14-30(15-11-23)26-28-24-4-2-3-5-25(24)31(26)19-20-6-8-22(27)9-7-20/h2-9,21,23H,10-19H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]pyrilamine from human histamine H1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50316921
((S)-1-(1-(2-ethoxyethyl)-1H-benzo[d]imidazol-2-yl)...)Show SMILES CCOCCn1c(nc2ccccc12)N1CC[C@@H](C1)N(C)C |r| Show InChI InChI=1S/C17H26N4O/c1-4-22-12-11-21-16-8-6-5-7-15(16)18-17(21)20-10-9-14(13-20)19(2)3/h5-8,14H,4,9-13H2,1-3H3/t14-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]pyrilamine from human histamine H1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50297850
(1-(4-fluorobenzyl)-2-(4-(4-methyl-1H-pyrazol-1-yl)...)Show SMILES Cc1cnn(c1)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(F)cc1 Show InChI InChI=1S/C23H24FN5/c1-17-14-25-29(15-17)20-10-12-27(13-11-20)23-26-21-4-2-3-5-22(21)28(23)16-18-6-8-19(24)9-7-18/h2-9,14-15,20H,10-13,16H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| 6.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]pyrilamine from human histamine H1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM50316922
((R)-1-(1-(4-methoxybenzyl)-1H-benzo[d]imidazol-2-y...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)N2CC[C@H](C2)N(C)C)cc1 |r| Show InChI InChI=1S/C21H26N4O/c1-23(2)17-12-13-24(15-17)21-22-19-6-4-5-7-20(19)25(21)14-16-8-10-18(26-3)11-9-16/h4-11,17H,12-15H2,1-3H3/t17-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]pyrilamine from human histamine H1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316932
(2-(1-methylpiperidin-3-yl)-1-((tetrahydrofuran-2-y...)Show InChI InChI=1S/C18H25N3O/c1-20-10-4-6-14(12-20)18-19-16-8-2-3-9-17(16)21(18)13-15-7-5-11-22-15/h2-3,8-9,14-15H,4-7,10-13H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 638 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316930
(2-(1-cyclohexylpiperidin-3-yl)-1-(4-fluorobenzyl)-...)Show SMILES Fc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCCCC2)cc1 Show InChI InChI=1S/C25H30FN3/c26-21-14-12-19(13-15-21)17-29-24-11-5-4-10-23(24)27-25(29)20-7-6-16-28(18-20)22-8-2-1-3-9-22/h4-5,10-15,20,22H,1-3,6-9,16-18H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 926 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316924
(2-((2-(1-cyclohexylpiperidin-3-yl)-1H-benzo[d]imid...)Show SMILES Cc1csc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCCCC2)n1 Show InChI InChI=1S/C23H30N4S/c1-17-16-28-22(24-17)15-27-21-12-6-5-11-20(21)25-23(27)18-8-7-13-26(14-18)19-9-3-2-4-10-19/h5-6,11-12,16,18-19H,2-4,7-10,13-15H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.18E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316935
(1-(2-ethoxyethyl)-2-(1-methylpiperidin-3-yl)-1H-be...)Show InChI InChI=1S/C17H25N3O/c1-3-21-12-11-20-16-9-5-4-8-15(16)18-17(20)14-7-6-10-19(2)13-14/h4-5,8-9,14H,3,6-7,10-13H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316931
(1-(4-fluorobenzyl)-2-(1-isopropylpiperidin-3-yl)-1...)Show InChI InChI=1S/C22H26FN3/c1-16(2)25-13-5-6-18(15-25)22-24-20-7-3-4-8-21(20)26(22)14-17-9-11-19(23)12-10-17/h3-4,7-12,16,18H,5-6,13-15H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50316921
((S)-1-(1-(2-ethoxyethyl)-1H-benzo[d]imidazol-2-yl)...)Show SMILES CCOCCn1c(nc2ccccc12)N1CC[C@@H](C1)N(C)C |r| Show InChI InChI=1S/C17H26N4O/c1-4-22-12-11-21-16-8-6-5-7-15(16)18-17(21)20-10-9-14(13-20)19(2)3/h5-8,14H,4,9-13H2,1-3H3/t14-/m0/s1 | UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]N-methyl scopolamine from human muscarinic M1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316928
(2-(1-cyclohexylpiperidin-3-yl)-1-(4-methoxybenzyl)...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCCCC2)cc1 Show InChI InChI=1S/C26H33N3O/c1-30-23-15-13-20(14-16-23)18-29-25-12-6-5-11-24(25)27-26(29)21-8-7-17-28(19-21)22-9-3-2-4-10-22/h5-6,11-16,21-22H,2-4,7-10,17-19H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50316922
((R)-1-(1-(4-methoxybenzyl)-1H-benzo[d]imidazol-2-y...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)N2CC[C@H](C2)N(C)C)cc1 |r| Show InChI InChI=1S/C21H26N4O/c1-23(2)17-12-13-24(15-17)21-22-19-6-4-5-7-20(19)25(21)14-16-8-10-18(26-3)11-9-16/h4-11,17H,12-15H2,1-3H3/t17-/m1/s1 | UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]N-methyl scopolamine from human muscarinic M1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316929
(2-(1-isopropylpiperidin-3-yl)-1-(4-methoxybenzyl)-...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C(C)C)cc1 Show InChI InChI=1S/C23H29N3O/c1-17(2)25-14-6-7-19(16-25)23-24-21-8-4-5-9-22(21)26(23)15-18-10-12-20(27-3)13-11-18/h4-5,8-13,17,19H,6-7,14-16H2,1-3H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316939
((R)-1-(2-ethoxyethyl)-2-(1-(tetrahydro-2H-pyran-4-...)Show SMILES CCOCCn1c(nc2ccccc12)[C@@H]1CCCN(C1)C1CCOCC1 |r| Show InChI InChI=1S/C21H31N3O2/c1-2-25-15-12-24-20-8-4-3-7-19(20)22-21(24)17-6-5-11-23(16-17)18-9-13-26-14-10-18/h3-4,7-8,17-18H,2,5-6,9-16H2,1H3/t17-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316925
(2-(1-cyclohexylpiperidin-3-yl)-1-(2-ethoxyethyl)-1...)Show InChI InChI=1S/C21H31N3O2/c1-2-25-15-12-24-20-8-4-3-7-19(20)22-21(24)17-6-5-11-23(16-17)18-9-13-26-14-10-18/h3-4,7-8,17-18H,2,5-6,9-16H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316923
(4-methyl-2-((2-(1-(tetrahydro-2H-pyran-4-yl)piperi...)Show SMILES Cc1csc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCOCC2)n1 Show InChI InChI=1S/C22H28N4OS/c1-16-15-28-21(23-16)14-26-20-7-3-2-6-19(20)24-22(26)17-5-4-10-25(13-17)18-8-11-27-12-9-18/h2-3,6-7,15,17-18H,4-5,8-14H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316940
((R)-1-(4-fluorobenzyl)-2-(1-methylpiperidin-3-yl)-...)Show SMILES CN1CCC[C@H](C1)c1nc2ccccc2n1Cc1ccc(F)cc1 |r| Show InChI InChI=1S/C20H22FN3/c1-23-12-4-5-16(14-23)20-22-18-6-2-3-7-19(18)24(20)13-15-8-10-17(21)11-9-15/h2-3,6-11,16H,4-5,12-14H2,1H3/t16-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50297861
(1-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)-N-...)Show SMILES CN(CC1CCOCC1)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(F)cc1 Show InChI InChI=1S/C26H33FN4O/c1-29(18-21-12-16-32-17-13-21)23-10-14-30(15-11-23)26-28-24-4-2-3-5-25(24)31(26)19-20-6-8-22(27)9-7-20/h2-9,21,23H,10-19H2,1H3 | UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]N-methyl scopolamine from human muscarinic M1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316937
(1-(4-methoxybenzyl)-2-(1-methylpiperidin-3-yl)-1H-...)Show InChI InChI=1S/C21H25N3O/c1-23-13-5-6-17(15-23)21-22-19-7-3-4-8-20(19)24(21)14-16-9-11-18(25-2)12-10-16/h3-4,7-12,17H,5-6,13-15H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316936
(2-(1-methylpiperidin-3-yl)-1-(2-phenoxyethyl)-1H-b...)Show InChI InChI=1S/C21H25N3O/c1-23-13-7-8-17(16-23)21-22-19-11-5-6-12-20(19)24(21)14-15-25-18-9-3-2-4-10-18/h2-6,9-12,17H,7-8,13-16H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 5.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316945
((S)-1-(4-fluorobenzyl)-2-(1-methylpiperidin-3-yl)-...)Show SMILES CN1CCC[C@@H](C1)c1nc2ccccc2n1Cc1ccc(F)cc1 |r| Show InChI InChI=1S/C20H22FN3/c1-23-12-4-5-16(14-23)20-22-18-6-2-3-7-19(18)24(20)13-15-8-10-17(21)11-9-15/h2-3,6-11,16H,4-5,12-14H2,1H3/t16-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6.52E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316938
(1-(4-fluorobenzyl)-2-(1-methylpiperidin-3-yl)-1H-b...)Show InChI InChI=1S/C20H22FN3/c1-23-12-4-5-16(14-23)20-22-18-6-2-3-7-19(18)24(20)13-15-8-10-17(21)11-9-15/h2-3,6-11,16H,4-5,12-14H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316943
((S)-1-(2-ethoxyethyl)-2-(1-methylpiperidin-3-yl)-1...)Show InChI InChI=1S/C17H25N3O/c1-3-21-12-11-20-16-9-5-4-8-15(16)18-17(20)14-7-6-10-19(2)13-14/h4-5,8-9,14H,3,6-7,10-13H2,1-2H3/t14-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316944
((R)-1-(2-ethoxyethyl)-2-(1-methylpiperidin-3-yl)-1...)Show InChI InChI=1S/C17H25N3O/c1-3-21-12-11-20-16-9-5-4-8-15(16)18-17(20)14-7-6-10-19(2)13-14/h4-5,8-9,14H,3,6-7,10-13H2,1-2H3/t14-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316926
(1-(2-ethoxyethyl)-2-(1-(tetrahydro-2H-pyran-4-yl)p...)Show InChI InChI=1S/C22H33N3O/c1-2-26-16-15-25-21-13-7-6-12-20(21)23-22(25)18-9-8-14-24(17-18)19-10-4-3-5-11-19/h6-7,12-13,18-19H,2-5,8-11,14-17H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316927
(1-(4-methoxybenzyl)-2-(1-(tetrahydro-2H-pyran-4-yl...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCOCC2)cc1 Show InChI InChI=1S/C25H31N3O2/c1-29-22-10-8-19(9-11-22)17-28-24-7-3-2-6-23(24)26-25(28)20-5-4-14-27(18-20)21-12-15-30-16-13-21/h2-3,6-11,20-21H,4-5,12-18H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316941
((S)-2-(1-methylpiperidin-3-yl)-1-(pyridin-2-ylmeth...)Show InChI InChI=1S/C19H22N4/c1-22-12-6-7-15(13-22)19-21-17-9-2-3-10-18(17)23(19)14-16-8-4-5-11-20-16/h2-5,8-11,15H,6-7,12-14H2,1H3/t15-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316934
(2-(1-methylpiperidin-3-yl)-1-(pyridin-2-ylmethyl)-...)Show InChI InChI=1S/C19H22N4/c1-22-12-6-7-15(13-22)19-21-17-9-2-3-10-18(17)23(19)14-16-8-4-5-11-20-16/h2-5,8-11,15H,6-7,12-14H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316933
(4-methyl-2-((2-(1-methylpiperidin-3-yl)-1H-benzo[d...)Show InChI InChI=1S/C18H22N4S/c1-13-12-23-17(19-13)11-22-16-8-4-3-7-15(16)20-18(22)14-6-5-9-21(2)10-14/h3-4,7-8,12,14H,5-6,9-11H2,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Muscarinic acetylcholine receptor M1
(Homo sapiens (Human)) | BDBM50297850
(1-(4-fluorobenzyl)-2-(4-(4-methyl-1H-pyrazol-1-yl)...)Show SMILES Cc1cnn(c1)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(F)cc1 Show InChI InChI=1S/C23H24FN5/c1-17-14-25-29(15-17)20-10-12-27(13-11-20)23-26-21-4-2-3-5-22(21)28(23)16-18-6-8-19(24)9-7-18/h2-9,14-15,20H,10-13,16H2,1H3 | UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]N-methyl scopolamine from human muscarinic M1 receptor expressed in CHO Flp-In cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316942
((R)-2-(1-methylpiperidin-3-yl)-1-(pyridin-2-ylmeth...)Show InChI InChI=1S/C19H22N4/c1-22-12-6-7-15(13-22)19-21-17-9-2-3-10-18(17)23(19)14-16-8-4-5-11-20-16/h2-5,8-11,15H,6-7,12-14H2,1H3/t15-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Displacement of [3H]dofetolide from human ERG channel expressed in HEK293 cells by liquid scintillation counting |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50297861
(1-(1-(4-fluorobenzyl)-1H-benzo[d]imidazol-2-yl)-N-...)Show SMILES CN(CC1CCOCC1)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(F)cc1 Show InChI InChI=1S/C26H33FN4O/c1-29(18-21-12-16-32-17-13-21)23-10-14-30(15-11-23)26-28-24-4-2-3-5-25(24)31(26)19-20-6-8-22(27)9-7-20/h2-9,21,23H,10-19H2,1H3 | 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 | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of human ERG channel by electrophysiology assay |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316921
((S)-1-(1-(2-ethoxyethyl)-1H-benzo[d]imidazol-2-yl)...)Show SMILES CCOCCn1c(nc2ccccc12)N1CC[C@@H](C1)N(C)C |r| Show InChI InChI=1S/C17H26N4O/c1-4-22-12-11-21-16-8-6-5-7-15(16)18-17(21)20-10-9-14(13-20)19(2)3/h5-8,14H,4,9-13H2,1-3H3/t14-/m0/s1 | 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 | 233 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of human ERG channel by electrophysiology assay |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316922
((R)-1-(1-(4-methoxybenzyl)-1H-benzo[d]imidazol-2-y...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)N2CC[C@H](C2)N(C)C)cc1 |r| Show InChI InChI=1S/C21H26N4O/c1-23(2)17-12-13-24(15-17)21-22-19-6-4-5-7-20(19)25(21)14-16-8-10-18(26-3)11-9-16/h4-11,17H,12-15H2,1-3H3/t17-/m1/s1 | 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 | 492 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of human ERG channel by electrophysiology assay |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316940
((R)-1-(4-fluorobenzyl)-2-(1-methylpiperidin-3-yl)-...)Show SMILES CN1CCC[C@H](C1)c1nc2ccccc2n1Cc1ccc(F)cc1 |r| Show InChI InChI=1S/C20H22FN3/c1-23-12-4-5-16(14-23)20-22-18-6-2-3-7-19(18)24(20)13-15-8-10-17(21)11-9-15/h2-3,6-11,16H,4-5,12-14H2,1H3/t16-/m1/s1 | 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 | 721 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of human ERG channel by patch clamp assay |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50297850
(1-(4-fluorobenzyl)-2-(4-(4-methyl-1H-pyrazol-1-yl)...)Show SMILES Cc1cnn(c1)C1CCN(CC1)c1nc2ccccc2n1Cc1ccc(F)cc1 Show InChI InChI=1S/C23H24FN5/c1-17-14-25-29(15-17)20-10-12-27(13-11-20)23-26-21-4-2-3-5-22(21)28(23)16-18-6-8-19(24)9-7-18/h2-9,14-15,20H,10-13,16H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 809 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of human ERG channel by electrophysiology assay |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50316939
((R)-1-(2-ethoxyethyl)-2-(1-(tetrahydro-2H-pyran-4-...)Show SMILES CCOCCn1c(nc2ccccc12)[C@@H]1CCCN(C1)C1CCOCC1 |r| Show InChI InChI=1S/C21H31N3O2/c1-2-25-15-12-24-20-8-4-3-7-19(20)22-21(24)17-6-5-11-23(16-17)18-9-13-26-14-10-18/h3-4,7-8,17-18H,2,5-6,9-16H2,1H3/t17-/m1/s1 | 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 | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of human ERG channel by patch clamp assay |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316928
(2-(1-cyclohexylpiperidin-3-yl)-1-(4-methoxybenzyl)...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCCCC2)cc1 Show InChI InChI=1S/C26H33N3O/c1-30-23-15-13-20(14-16-23)18-29-25-12-6-5-11-24(25)27-26(29)21-8-7-17-28(19-21)22-9-3-2-4-10-22/h5-6,11-16,21-22H,2-4,7-10,17-19H2,1H3 | 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 | 3.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316938
(1-(4-fluorobenzyl)-2-(1-methylpiperidin-3-yl)-1H-b...)Show InChI InChI=1S/C20H22FN3/c1-23-12-4-5-16(14-23)20-22-18-6-2-3-7-19(18)24(20)13-15-8-10-17(21)11-9-15/h2-3,6-11,16H,4-5,12-14H2,1H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316937
(1-(4-methoxybenzyl)-2-(1-methylpiperidin-3-yl)-1H-...)Show InChI InChI=1S/C21H25N3O/c1-23-13-5-6-17(15-23)21-22-19-7-3-4-8-20(19)24(21)14-16-9-11-18(25-2)12-10-16/h3-4,7-12,17H,5-6,13-15H2,1-2H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316936
(2-(1-methylpiperidin-3-yl)-1-(2-phenoxyethyl)-1H-b...)Show InChI InChI=1S/C21H25N3O/c1-23-13-7-8-17(16-23)21-22-19-11-5-6-12-20(19)24(21)14-15-25-18-9-3-2-4-10-18/h2-6,9-12,17H,7-8,13-16H2,1H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316935
(1-(2-ethoxyethyl)-2-(1-methylpiperidin-3-yl)-1H-be...)Show InChI InChI=1S/C17H25N3O/c1-3-21-12-11-20-16-9-5-4-8-15(16)18-17(20)14-7-6-10-19(2)13-14/h4-5,8-9,14H,3,6-7,10-13H2,1-2H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316934
(2-(1-methylpiperidin-3-yl)-1-(pyridin-2-ylmethyl)-...)Show InChI InChI=1S/C19H22N4/c1-22-12-6-7-15(13-22)19-21-17-9-2-3-10-18(17)23(19)14-16-8-4-5-11-20-16/h2-5,8-11,15H,6-7,12-14H2,1H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316933
(4-methyl-2-((2-(1-methylpiperidin-3-yl)-1H-benzo[d...)Show InChI InChI=1S/C18H22N4S/c1-13-12-23-17(19-13)11-22-16-8-4-3-7-15(16)20-18(22)14-6-5-9-21(2)10-14/h3-4,7-8,12,14H,5-6,9-11H2,1-2H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316932
(2-(1-methylpiperidin-3-yl)-1-((tetrahydrofuran-2-y...)Show InChI InChI=1S/C18H25N3O/c1-20-10-4-6-14(12-20)18-19-16-8-2-3-9-17(16)21(18)13-15-7-5-11-22-15/h2-3,8-9,14-15H,4-7,10-13H2,1H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316931
(1-(4-fluorobenzyl)-2-(1-isopropylpiperidin-3-yl)-1...)Show InChI InChI=1S/C22H26FN3/c1-16(2)25-13-5-6-18(15-25)22-24-20-7-3-4-8-21(20)26(22)14-17-9-11-19(23)12-10-17/h3-4,7-12,16,18H,5-6,13-15H2,1-2H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316930
(2-(1-cyclohexylpiperidin-3-yl)-1-(4-fluorobenzyl)-...)Show SMILES Fc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCCCC2)cc1 Show InChI InChI=1S/C25H30FN3/c26-21-14-12-19(13-15-21)17-29-24-11-5-4-10-23(24)27-25(29)20-7-6-16-28(18-20)22-8-2-1-3-9-22/h4-5,10-15,20,22H,1-3,6-9,16-18H2 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316929
(2-(1-isopropylpiperidin-3-yl)-1-(4-methoxybenzyl)-...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C(C)C)cc1 Show InChI InChI=1S/C23H29N3O/c1-17(2)25-14-6-7-19(16-25)23-24-21-8-4-5-9-22(21)26(23)15-18-10-12-20(27-3)13-11-18/h4-5,8-13,17,19H,6-7,14-16H2,1-3H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316927
(1-(4-methoxybenzyl)-2-(1-(tetrahydro-2H-pyran-4-yl...)Show SMILES COc1ccc(Cn2c(nc3ccccc23)C2CCCN(C2)C2CCOCC2)cc1 Show InChI InChI=1S/C25H31N3O2/c1-29-22-10-8-19(9-11-22)17-28-24-7-3-2-6-23(24)26-25(28)20-5-4-14-27(18-20)21-12-15-30-16-13-21/h2-3,6-11,20-21H,4-5,12-18H2,1H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50316926
(1-(2-ethoxyethyl)-2-(1-(tetrahydro-2H-pyran-4-yl)p...)Show InChI InChI=1S/C22H33N3O/c1-2-26-16-15-25-21-13-7-6-12-20(21)23-22(25)18-9-8-14-24(17-18)19-10-4-3-5-11-19/h6-7,12-13,18-19H,2-5,8-11,14-17H2,1H3 | 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 | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 |
Bioorg Med Chem Lett 20: 2916-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.03.027 BindingDB Entry DOI: 10.7270/Q20865G0 |
More data for this Ligand-Target Pair | |