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 |
|---|
Cathepsin D
(Homo sapiens (Human)) | BDBM50274107
(4-[(2-{(3S,4S)-5-(3,5-Difluoro-phenoxy)-3-hydroxy-...)Show SMILES C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)NCC(=O)NCc1ccc(cc1)C(O)=O)N(C)S(C)(=O)=O)c1ccccc1 |r| Show InChI InChI=1S/C39H41F2N5O10S/c1-23(25-7-5-4-6-8-25)44-37(50)27-13-28(15-31(14-27)46(2)57(3,54)55)38(51)45-33(22-56-32-17-29(40)16-30(41)18-32)34(47)19-35(48)43-21-36(49)42-20-24-9-11-26(12-10-24)39(52)53/h4-18,23,33-34,47H,19-22H2,1-3H3,(H,42,49)(H,43,48)(H,44,50)(H,45,51)(H,52,53)/t23-,33+,34+/m1/s1 | PDB
MMDB
NCI pathway
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 |
Linköping University
Curated by ChEMBL
| Assay Description
Inhibition of human cathepsin D |
Bioorg Med Chem 16: 9471-86 (2008)
Article DOI: 10.1016/j.bmc.2008.09.041
BindingDB Entry DOI: 10.7270/Q2VD6Z8Z |
More data for this
Ligand-Target Pair | |
Beta-secretase 1
(Homo sapiens (Human)) | BDBM50274107
(4-[(2-{(3S,4S)-5-(3,5-Difluoro-phenoxy)-3-hydroxy-...)Show SMILES C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](COc1cc(F)cc(F)c1)[C@@H](O)CC(=O)NCC(=O)NCc1ccc(cc1)C(O)=O)N(C)S(C)(=O)=O)c1ccccc1 |r| Show InChI InChI=1S/C39H41F2N5O10S/c1-23(25-7-5-4-6-8-25)44-37(50)27-13-28(15-31(14-27)46(2)57(3,54)55)38(51)45-33(22-56-32-17-29(40)16-30(41)18-32)34(47)19-35(48)43-21-36(49)42-20-24-9-11-26(12-10-24)39(52)53/h4-18,23,33-34,47H,19-22H2,1-3H3,(H,42,49)(H,43,48)(H,44,50)(H,45,51)(H,52,53)/t23-,33+,34+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Linköping University
Curated by ChEMBL
| Assay Description
Inhibition of human BACE1 expressed in Escherichia coli BL21(DE3) by resolved fluorescence assay |
Bioorg Med Chem 16: 9471-86 (2008)
Article DOI: 10.1016/j.bmc.2008.09.041
BindingDB Entry DOI: 10.7270/Q2VD6Z8Z |
More data for this
Ligand-Target Pair | |