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SMILES: CC(C)CCNC(=O)N(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1)C(C)(C)C

InChI Key: InChIKey=MEOZZXJKRIDSRG-YTCPBCGMSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50407051   
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)		BDBM50407051
PNG
(CHEMBL132432)
Show SMILES CC(C)CCNC(=O)N(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccc2ccccc2n1)C(C)(C)C
Show InChI InChI=1S/C34H46N6O5/c1-22(2)17-18-36-33(45)40(34(3,4)5)21-29(41)27(19-23-11-7-6-8-12-23)38-32(44)28(20-30(35)42)39-31(43)26-16-15-24-13-9-10-14-25(24)37-26/h6-16,22,27-29,41H,17-21H2,1-5H3,(H2,35,42)(H,36,45)(H,38,44)(H,39,43)/t27-,28-,29+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 3n/an/an/an/an/an/a



Washington University

Curated by ChEMBL


Assay Description
Inhibitory potency against HIV-1 protease

J Med Chem 36: 4152-60 (1994)


BindingDB Entry DOI: 10.7270/Q2PK0HCT
More data for this
Ligand-Target Pair