BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gag-Pol polyprotein [489-587]' and Ligand = 'BDBM50091618'   
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)		BDBM50091618
PNG
(4-Furo[3,2-b]pyridin-6-ylmethyl-1-[2-hydroxy-4-(2-...)
Show SMILES CC(C)(C)NC(=O)[C@@H]1CN(Cc2cnc3ccoc3c2)CCN1C[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)NC1[C@H](O)Cc2ccccc12
Show InChI InChI=1S/C38H47N5O5/c1-38(2,3)41-37(47)32-24-42(22-26-18-34-31(39-21-26)13-16-48-34)14-15-43(32)23-29(44)19-28(17-25-9-5-4-6-10-25)36(46)40-35-30-12-8-7-11-27(30)20-33(35)45/h4-13,16,18,21,28-29,32-33,35,44-45H,14-15,17,19-20,22-24H2,1-3H3,(H,40,46)(H,41,47)/t28-,29+,32+,33-,35?/m1/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 0.170n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 protease in vitro.

J Med Chem 43: 3386-99 (2000)


BindingDB Entry DOI: 10.7270/Q23J3DP4
More data for this
Ligand-Target Pair