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Compile Data Set for Download or QSAR

Found 2 hits with Last Name = 'hoog' and Initial = 'ss'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM50032937
PNG
(2-{2-[(S)-2-(3-Benzyl-5-{1-[(1-carboxy-ethyl)-meth...)
Show SMILES COC(=O)C(NC(=O)C(NC(=O)[C@H](C)N1CCC(=CC(Cc2ccccc2)C1)C(C)N(C)C(C)C(O)=O)C(C)C)C(C)C |c:17|
Show InChI InChI=1S/C33H52N4O6/c1-20(2)28(31(39)35-29(21(3)4)33(42)43-9)34-30(38)23(6)37-16-15-27(22(5)36(8)24(7)32(40)41)18-26(19-37)17-25-13-11-10-12-14-25/h10-14,18,20-24,26,28-29H,15-17,19H2,1-9H3,(H,34,38)(H,35,39)(H,40,41)/t22?,23-,24?,26?,28?,29?/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
430n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Competitive inhibitory activity of the compound was determined against HIV-1 protease


J Med Chem 38: 3246-52 (1995)


BindingDB Entry DOI: 10.7270/Q2RX9B43
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM50032938
PNG
(2-{2-[(S)-2-(3-Benzyl-5-{1-[(1-carboxy-ethyl)-meth...)
Show SMILES COC(=O)C(NC(=O)C(NC(=O)[C@H](C)N1CCC(=CC(Cc2ccccc2)C1=O)C(C)N(C)C(C)C(O)=O)C(C)C)C(C)C |c:17|
Show InChI InChI=1S/C33H50N4O7/c1-19(2)27(30(39)35-28(20(3)4)33(43)44-9)34-29(38)22(6)37-16-15-25(21(5)36(8)23(7)32(41)42)18-26(31(37)40)17-24-13-11-10-12-14-24/h10-14,18-23,26-28H,15-17H2,1-9H3,(H,34,38)(H,35,39)(H,41,42)/t21?,22-,23?,26?,27?,28?/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.47E+5n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Competitive inhibitory activity of the compound was determined against HIV-1 protease


J Med Chem 38: 3246-52 (1995)


BindingDB Entry DOI: 10.7270/Q2RX9B43
More data for this
Ligand-Target Pair