Found 2 hits in this display 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 |
Renin
(Homo sapiens (Human)) | BDBM50066150
(CHEMBL3401537)Show SMILES COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(C)C |r| Show InChI InChI=1S/C32H41N3O7S/c1-23(2)35(32(36)24-11-16-30(40-4)31(19-24)41-18-8-17-39-3)22-25-20-33-21-29(25)34-43(37,38)28-14-12-27(13-15-28)42-26-9-6-5-7-10-26/h5-7,9-16,19,23,25,29,33-34H,8,17-18,20-22H2,1-4H3/t25-,29+/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 | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Pharma AG
Curated by ChEMBL
| Assay Description Inhibition of recombinant human renin by fluorescence based FRET assay |
Bioorg Med Chem Lett 25: 1782-6 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.039 BindingDB Entry DOI: 10.7270/Q2Z039TX |
More data for this Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50066150
(CHEMBL3401537)Show SMILES COCCCOc1cc(ccc1OC)C(=O)N(C[C@@H]1CNC[C@H]1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(C)C |r| Show InChI InChI=1S/C32H41N3O7S/c1-23(2)35(32(36)24-11-16-30(40-4)31(19-24)41-18-8-17-39-3)22-25-20-33-21-29(25)34-43(37,38)28-14-12-27(13-15-28)42-26-9-6-5-7-10-26/h5-7,9-16,19,23,25,29,33-34H,8,17-18,20-22H2,1-4H3/t25-,29+/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 | 880 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Pharma AG
Curated by ChEMBL
| Assay Description Inhibition of recombinant human renin by fluorescence based FRET assay in presence of plasma |
Bioorg Med Chem Lett 25: 1782-6 (2015)
Article DOI: 10.1016/j.bmcl.2015.02.039 BindingDB Entry DOI: 10.7270/Q2Z039TX |
More data for this Ligand-Target Pair | |