Found 13 hits for monomerid = 50312769 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Muscarinic acetylcholine receptor M3
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of muscarinic M3 receptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Sodium-dependent noradrenaline transporter
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of NET |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Histamine H2 receptor
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of histamine H2 receptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
5-hydroxytryptamine receptor 2C
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of 5HT2C (receptor) |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
D(2) dopamine receptor
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of dopamine D2 rceptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
5-hydroxytryptamine receptor 2A
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of 5HT2A (receptor) |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of kappa opioid receptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of SERT |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Alpha-2A adrenergic receptor
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of alpha2A adrenergic receptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
D(3) dopamine receptor
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
UniProtKB/SwissProt
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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of dopamine D3 rceptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Sodium-dependent dopamine transporter
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank 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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of DAT |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
NCI pathway 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 |
Amgen Inc.
Curated by ChEMBL
| Assay Description Inhibition of mu opioid receptor |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |
Growth hormone secretagogue receptor type 1
(Homo sapiens (Human)) | BDBM50312769
((S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-...)Show SMILES C[C@H]1CN(CCN1C(=O)c1ccc2cc[nH]c2c1)C(=O)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C27H24FN3O2/c1-18-17-30(14-15-31(18)27(33)23-7-4-21-12-13-29-25(21)16-23)26(32)22-5-2-19(3-6-22)20-8-10-24(28)11-9-20/h2-13,16,18,29H,14-15,17H2,1H3/t18-/m0/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 64 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description Antagonist activity at human GHSR expressed in CHOK1 cells assessed as inhibition of ghrelin-induced intracellular calcium flux by aequorin flash lum... |
Bioorg Med Chem Lett 20: 1758-62 (2010)
Article DOI: 10.1016/j.bmcl.2010.01.043 BindingDB Entry DOI: 10.7270/Q2WM1DJD |
More data for this Ligand-Target Pair | |