BindingDB logo
myBDB logout

null

SMILES: Cc1cc(N)cc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N(Cc1ccccc1)NC(=O)c1cccc(O)c1C

InChI Key: InChIKey=CCMWJBLUUBHGCP-NYDCQLBNSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50121733   
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)		BDBM50121733
PNG
(2-(4-Amino-2,6-dimethyl-phenoxy)-N-[(S)-3-[N-benzy...)
Show SMILES Cc1cc(N)cc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N(Cc1ccccc1)NC(=O)c1cccc(O)c1C
Show InChI InChI=1S/C35H38N4O6/c1-22-17-27(36)18-23(2)33(22)45-21-31(41)37-29(19-25-11-6-4-7-12-25)32(42)35(44)39(20-26-13-8-5-9-14-26)38-34(43)28-15-10-16-30(40)24(28)3/h4-18,29,32,40,42H,19-21,36H2,1-3H3,(H,37,41)(H,38,43)/t29-,32-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

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

Similars
PubMed
 5n/an/an/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against HIV-1 protease

Bioorg Med Chem Lett 13: 93-6 (2002)


BindingDB Entry DOI: 10.7270/Q2N29W9D
More data for this
Ligand-Target Pair