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SMILES: Cc1cccc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)[C@H](O)[C@H](Cc2ccccc2)NC(=O)c2cccc(C)c2NC(=O)OCc2ccccc2)c1NC(=O)OCc1ccccc1

InChI Key: InChIKey=AXBPJOLNOGCNTJ-KKWITKANSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50285699   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/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)		BDBM50285699
PNG
(Anthranilamide derivative | CHEMBL87879)
Show SMILES Cc1cccc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)[C@H](O)[C@H](Cc2ccccc2)NC(=O)c2cccc(C)c2NC(=O)OCc2ccccc2)c1NC(=O)OCc1ccccc1
Show InChI InChI=1S/C50H50N4O8/c1-33-17-15-27-39(43(33)53-49(59)61-31-37-23-11-5-12-24-37)47(57)51-41(29-35-19-7-3-8-20-35)45(55)46(56)42(30-36-21-9-4-10-22-36)52-48(58)40-28-16-18-34(2)44(40)54-50(60)62-32-38-25-13-6-14-26-38/h3-28,41-42,45-46,55-56H,29-32H2,1-2H3,(H,51,57)(H,52,58)(H,53,59)(H,54,60)/t41-,42-,45-,46+/m0/s1
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Similars
Article
 12n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of HIV protease using fluorogenic substrate

Bioorg Med Chem Lett 5: 2557-2562 (1995)


Article DOI: 10.1016/0960-894X(95)00449-4
BindingDB Entry DOI: 10.7270/Q2RB74KT
More data for this
Ligand-Target Pair