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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'HIV-1 protease' and Ligand = 'BDBM81674'   
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
HIV-1 protease


(Human immunodeficiency virus)		BDBM81674
PNG
(CARB-AD08)
Show SMILES COc1cccc(c1)S(=O)(=O)N(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccnc(OC)c1)CC1CCCO1 |r|
Show InChI InChI=1S/C29H35N3O7S/c1-37-23-10-6-12-25(18-23)40(35,36)32(19-24-11-7-15-39-24)20-27(33)26(16-21-8-4-3-5-9-21)31-29(34)22-13-14-30-28(17-22)38-2/h3-6,8-10,12-14,17-18,24,26-27,33H,7,11,15-16,19-20H2,1-2H3,(H,31,34)/t24?,26-,27+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 110n/an/an/an/an/an/an/an/a



University of Maryland



Assay Description
Inhibition assay using HIV protease and Sulfonamide compounds.

Chem Biol Drug Des 69: 298-313 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00514.x
BindingDB Entry DOI: 10.7270/Q2TQ6011
More data for this
Ligand-Target Pair