Found 72 hits with Last Name = 'jenny' and Initial = 'c' 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)) | BDBM50077678
((3R,4R)-3-(1,4-Dimethoxy-naphthalen-2-ylmethoxy)-4...)Show SMILES COc1ccccc1COCCCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1cc(OC)c2ccccc2c1OC Show InChI InChI=1S/C35H41NO6/c1-37-32-12-7-4-9-26(32)23-40-19-8-20-41-28-15-13-25(14-16-28)29-17-18-36-22-34(29)42-24-27-21-33(38-2)30-10-5-6-11-31(30)35(27)39-3/h4-7,9-16,21,29,34,36H,8,17-20,22-24H2,1-3H3/t29-,34+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 0.0870 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077702
(4-[(3S,4R,5R)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-5...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1[C@H](CSc2ccncc2)CNC[C@@H]1OCc1ccc2ccccc2c1 Show InChI InChI=1S/C38H40N2O3S/c1-2-7-29(8-3-1)26-41-21-6-22-42-35-15-13-32(14-16-35)38-34(28-44-36-17-19-39-20-18-36)24-40-25-37(38)43-27-30-11-12-31-9-4-5-10-33(31)23-30/h1-5,7-20,23,34,37-38,40H,6,21-22,24-28H2/t34-,37-,38-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| PubMed
| n/a | n/a | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077693
((3'R,4'R)-3'-(1,4-Dimethoxy-naphthalen-2-ylmethoxy...)Show SMILES COc1ccccc1COCCCOc1ccc(cn1)[C@H]1CCNC[C@@H]1OCc1cc(OC)c2ccccc2c1OC Show InChI InChI=1S/C34H40N2O6/c1-37-30-12-7-4-9-25(30)22-40-17-8-18-41-33-14-13-24(20-36-33)27-15-16-35-21-32(27)42-23-26-19-31(38-2)28-10-5-6-11-29(28)34(26)39-3/h4-7,9-14,19-20,27,32,35H,8,15-18,21-23H2,1-3H3/t27-,32+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077699
(7-((3R,4R)-4-{4-[3-(2-Methoxy-benzyloxy)-propoxy]-...)Show SMILES COc1ccccc1COCCCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2CCCNc2c1 Show InChI InChI=1S/C32H40N2O4/c1-35-31-8-3-2-6-27(31)23-36-18-5-19-37-28-13-11-25(12-14-28)29-15-17-33-21-32(29)38-22-24-9-10-26-7-4-16-34-30(26)20-24/h2-3,6,8-14,20,29,32-34H,4-5,7,15-19,21-23H2,1H3/t29-,32+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 0.670 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against human plasma renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077692
((3R,4R,5S)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-3-(n...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1[C@H](Cn2cncn2)CNC[C@@H]1OCc1ccc2ccccc2c1 Show InChI InChI=1S/C35H38N4O3/c1-2-7-27(8-3-1)23-40-17-6-18-41-33-15-13-30(14-16-33)35-32(22-39-26-37-25-38-39)20-36-21-34(35)42-24-28-11-12-29-9-4-5-10-31(29)19-28/h1-5,7-16,19,25-26,32,34-36H,6,17-18,20-24H2/t32-,34-,35-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| PubMed
| n/a | n/a | 0.920 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077703
(4-{2-[(3S,4R,5R)-4-[4-(3-Benzyloxy-propoxy)-phenyl...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1[C@@H](CNC[C@@H]1OCc1ccc2ccccc2c1)OCCN1CCOCC1 Show InChI InChI=1S/C38H46N2O5/c1-2-7-30(8-3-1)28-42-20-6-21-43-35-15-13-33(14-16-35)38-36(44-24-19-40-17-22-41-23-18-40)26-39-27-37(38)45-29-31-11-12-32-9-4-5-10-34(32)25-31/h1-5,7-16,25,36-39H,6,17-24,26-29H2/t36-,37+,38+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.80 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077704
(CHEMBL31880 | Sulfuric acid mono-[(3S,4R,5R)-4-[4-...)Show SMILES OS(=O)(=O)OC[C@@H]1CNC[C@H](OCc2ccc3ccccc3c2)[C@H]1c1ccc(OCCCOCc2ccccc2)cc1 Show InChI InChI=1S/C33H37NO7S/c35-42(36,37)41-24-30-20-34-21-32(40-23-26-11-12-27-9-4-5-10-29(27)19-26)33(30)28-13-15-31(16-14-28)39-18-6-17-38-22-25-7-2-1-3-8-25/h1-5,7-16,19,30,32-34H,6,17-18,20-24H2,(H,35,36,37)/t30-,32-,33-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| PubMed
| n/a | n/a | 2.30 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against human plasma renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077709
(4-{2-[(3S,4R,5R)-4-[4-(3-Benzyloxy-propoxy)-phenyl...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1[C@H](COCCN2CCOCC2)CNC[C@@H]1OCc1ccc2ccccc2c1 Show InChI InChI=1S/C39H48N2O5/c1-2-7-31(8-3-1)28-43-20-6-21-45-37-15-13-34(14-16-37)39-36(30-44-24-19-41-17-22-42-23-18-41)26-40-27-38(39)46-29-32-11-12-33-9-4-5-10-35(33)25-32/h1-5,7-16,25,36,38-40H,6,17-24,26-30H2/t36-,38-,39-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077695
(7-((3R,4R)-4-{4-[3-(2-Methoxy-benzyloxy)-propoxy]-...)Show SMILES COc1ccccc1COCCCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2cccnc2c1 Show InChI InChI=1S/C32H36N2O4/c1-35-31-8-3-2-6-27(31)23-36-18-5-19-37-28-13-11-25(12-14-28)29-15-17-33-21-32(29)38-22-24-9-10-26-7-4-16-34-30(26)20-24/h2-4,6-14,16,20,29,32-33H,5,15,17-19,21-23H2,1H3/t29-,32+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077689
((3R,4R)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-3-(naph...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2ccccc2c1 Show InChI InChI=1S/C32H35NO3/c1-2-7-25(8-3-1)23-34-19-6-20-35-30-15-13-28(14-16-30)31-17-18-33-22-32(31)36-24-26-11-12-27-9-4-5-10-29(27)21-26/h1-5,7-16,21,31-33H,6,17-20,22-24H2/t31-,32+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077694
(7-{(3R,4R)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-pipe...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2CCCNc2c1 Show InChI InChI=1S/C31H38N2O3/c1-2-6-24(7-3-1)22-34-18-5-19-35-28-13-11-26(12-14-28)29-15-17-32-21-31(29)36-23-25-9-10-27-8-4-16-33-30(27)20-25/h1-3,6-7,9-14,20,29,31-33H,4-5,8,15-19,21-23H2/t29-,31+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.10 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077705
((3S,4S,5R)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-5-(n...)Show SMILES O[C@@H]1CNC[C@H](OCc2ccc3ccccc3c2)[C@H]1c1ccc(OCCCOCc2ccccc2)cc1 Show InChI InChI=1S/C32H35NO4/c34-30-20-33-21-31(37-23-25-11-12-26-9-4-5-10-28(26)19-25)32(30)27-13-15-29(16-14-27)36-18-6-17-35-22-24-7-2-1-3-8-24/h1-5,7-16,19,30-34H,6,17-18,20-23H2/t30-,31+,32+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 6.40 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077697
(7-((3R,4R)-4-{4-[3-(2-Methoxy-benzyloxy)-propoxy]-...)Show SMILES COc1ccccc1COCCCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2ccc(=O)[nH]c2c1 Show InChI InChI=1S/C32H36N2O5/c1-36-30-6-3-2-5-26(30)22-37-17-4-18-38-27-12-9-24(10-13-27)28-15-16-33-20-31(28)39-21-23-7-8-25-11-14-32(35)34-29(25)19-23/h2-3,5-14,19,28,31,33H,4,15-18,20-22H2,1H3,(H,34,35)/t28-,31+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077707
((3R,4S,5R)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-5-(n...)Show SMILES O[C@H]1CNC[C@H](OCc2ccc3ccccc3c2)[C@H]1c1ccc(OCCCOCc2ccccc2)cc1 Show InChI InChI=1S/C32H35NO4/c34-30-20-33-21-31(37-23-25-11-12-26-9-4-5-10-28(26)19-25)32(30)27-13-15-29(16-14-27)36-18-6-17-35-22-24-7-2-1-3-8-24/h1-5,7-16,19,30-34H,6,17-18,20-23H2/t30-,31-,32-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077698
(5-[(3R,4R)-3-(1,4-Dimethoxy-naphthalen-2-ylmethoxy...)Show SMILES COc1ccccc1COCCCOc1ncc(cn1)[C@H]1CCNC[C@@H]1OCc1cc(OC)c2ccccc2c1OC Show InChI InChI=1S/C33H39N3O6/c1-37-29-12-7-4-9-23(29)21-40-15-8-16-41-33-35-18-25(19-36-33)26-13-14-34-20-31(26)42-22-24-17-30(38-2)27-10-5-6-11-28(27)32(24)39-3/h4-7,9-12,17-19,26,31,34H,8,13-16,20-22H2,1-3H3/t26-,31+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077678
((3R,4R)-3-(1,4-Dimethoxy-naphthalen-2-ylmethoxy)-4...)Show SMILES COc1ccccc1COCCCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1cc(OC)c2ccccc2c1OC Show InChI InChI=1S/C35H41NO6/c1-37-32-12-7-4-9-26(32)23-40-19-8-20-41-28-15-13-25(14-16-28)29-17-18-36-22-34(29)42-24-27-21-33(38-2)30-10-5-6-11-31(30)35(27)39-3/h4-7,9-16,21,29,34,36H,8,17-20,22-24H2,1-3H3/t29-,34+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against human plasma renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077706
(7-{(3R,4R)-4-[4-(3-Benzyloxy-propoxy)-phenyl]-pipe...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2cccnc2c1 Show InChI InChI=1S/C31H34N2O3/c1-2-6-24(7-3-1)22-34-18-5-19-35-28-13-11-26(12-14-28)29-15-17-32-21-31(29)36-23-25-9-10-27-8-4-16-33-30(27)20-25/h1-4,6-14,16,20,29,31-32H,5,15,17-19,21-23H2/t29-,31+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against purified recombinant human renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077696
(4-[2-(7-{(3R,4R)-4-[4-(3-Benzyloxy-propoxy)-phenyl...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2ccc(OCCN3CCOCC3)cc2c1 Show InChI InChI=1S/C38H46N2O5/c1-2-5-30(6-3-1)28-42-20-4-21-43-35-12-10-33(11-13-35)37-15-16-39-27-38(37)45-29-31-7-8-32-9-14-36(26-34(32)25-31)44-24-19-40-17-22-41-23-18-40/h1-3,5-14,25-26,37-39H,4,15-24,27-29H2/t37-,38+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against human plasma renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651522
(US20240050516, Example 12.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651507
(US20240050516, Example 4.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651514
(US20240050516, Example 8.02) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651523
(US20240050516, Example 13.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651526
(US20240050516, Example 15.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM612436
(US20240050516, Example 2.01)Show SMILES CC(=O)c1nn2CC(=O)N3[C@@H]4C[C@@]4(C[C@H]3C(=O)Nc3cc(Br)ccc3C3CC3)CNC(=O)CCCCCCc3cc(cc1c23)-c1cnc(C)nc1 |r| | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651527
(US20240050516, Example 16.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM281030
(4-[(11S,14S,17S)-14-(4-Amino-butyl)-11-(3-amino-pr...)Show SMILES CN1[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2c(Sc3ncccc3CN[C@@H](CCCN)C(=O)N[C@@H](CCCCN)C1=O)c(Cl)ccc2-c1ccc(cc1)C(O)=O |r| | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651516
(US20240050516, Example 9.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651512
(US20240050516, Example 8.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651524
(US20240050516, Example 14.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077708
(4-[2-(6-{(3R,4R)-4-[4-(3-Benzyloxy-propoxy)-phenyl...)Show SMILES C(COCc1ccccc1)COc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2cc(OCCN3CCOCC3)ccc2c1 Show InChI InChI=1S/C38H46N2O5/c1-2-5-30(6-3-1)28-42-20-4-21-43-35-12-9-32(10-13-35)37-15-16-39-27-38(37)45-29-31-7-8-34-26-36(14-11-33(34)25-31)44-24-19-40-17-22-41-23-18-40/h1-3,5-14,25-26,37-39H,4,15-24,27-29H2/t37-,38+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against human plasma renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651509
(US20240050516, Example 6.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651519
(US20240050516, Example 10.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651510
(US20240050516, Example 7.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651513
(US20240050516, Example 8.01) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM612443
(US20240050516, Example 2.02)Show SMILES CC(=O)c1nn2CC(=O)N3[C@@H]4C[C@@]4(C[C@H]3C(=O)Nc3nc(ccc3C)C(F)(F)F)CNC(=O)CCC\C=C\Cc3cc(cc1c23)-c1cnc(C)cn1 |r,w:38.40,t:39| | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM612454
(US20240050516, Example 2.03)Show SMILES CC(=O)c1nn2CC(=O)N3[C@@H]4C[C@@]4(C[C@H]3C(=O)Nc3nc(Br)ccc3F)CNC(=O)CCCCCCc3cc(cc1c23)-c1cnc(C)nc1 |r| | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Renin
(Homo sapiens (Human)) | BDBM50077699
(7-((3R,4R)-4-{4-[3-(2-Methoxy-benzyloxy)-propoxy]-...)Show SMILES COc1ccccc1COCCCOc1ccc(cc1)[C@H]1CCNC[C@@H]1OCc1ccc2CCCNc2c1 Show InChI InChI=1S/C32H40N2O4/c1-35-31-8-3-2-6-27(31)23-36-18-5-19-37-28-13-11-25(12-14-28)29-15-17-33-21-32(29)38-22-24-9-10-26-7-4-16-34-30(26)20-24/h2-3,6,8-14,20,29,32-34H,4-5,7,15-19,21-23H2,1H3/t29-,32+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd.
Curated by ChEMBL
| Assay Description
Inhibitory activity against human plasma renin |
Bioorg Med Chem Lett 9: 1403-8 (1999)
BindingDB Entry DOI: 10.7270/Q20P0Z6S |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651506
(US20240050516, Example 3.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651532
(US20240050516, Example 38 of WO2017/072062) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PDB
UniChem
| | n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651511
(2-[4-[(11S,14S,17S)-14-(4-Aminobutyl)-11-(3-aminop...) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 46 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM281032
(US10030047, Example 241 | US20240050516, Example 2...)Show SMILES CN1[C@@H](Cc2c[nH]c3ccccc23)C(=O)NCc2c(Sc3ncccc3CN[C@@H](CCCN)C(=O)N[C@@H](CCCCN)C1=O)c(Cl)ccc2-c1ccc(OCC(O)=O)cc1 |r| | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651508
(US20240050516, Example 5.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651521
(US20240050516, Example 11.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 71 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM612410
(US20240050516, Example 2.00)Show SMILES CN1C[C@]23C[C@H]2N([C@@H](C3)C(=O)Nc2nc(ccc2C)C(F)(F)F)C(=O)Cn2nc(C(C)=O)c3cc(cc(CCCCCC(C)(C)C1=O)c23)-c1cnc(C)nc1 |r| | UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651529
(US20240050516, Example 18.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651528
(US20240050516, Example 17.00) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 75 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651520
(2-[4-[(11S,14S,17S)-14-(4-Aminobutyl)-11-(3-aminop...) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 78 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651515
(US20240050516, Example 8.03) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 78 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651517
(US20240050516, Example 9.01) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 81 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
Adhesin Ata autotransporter
(Acinetobacter baumannii (strain ATCC 17978 / CIP 5...) | BDBM651518
(US20240050516, Example 9.02) | UniProtKB/SwissProt
GoogleScholar
AffyNet
| UniChem
| | n/a | n/a | 88 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2S186N4 |
More data for this
Ligand-Target Pair | |
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