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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50136007'   
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
Genome polyprotein


(Human rhinovirus B)		BDBM50136007
PNG
((S)-4-((S)-2-Acetylamino-3-carboxy-propionylamino)...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CSC)C(O)=O
Show InChI InChI=1S/C36H60N6O12S/c1-7-20(4)30(35(52)40-25(16-22-11-9-8-10-12-22)32(49)41-27(18-55-6)36(53)54)42-34(51)24(15-19(2)3)39-31(48)23(13-14-28(44)45)38-33(50)26(17-29(46)47)37-21(5)43/h19-20,22-27,30H,7-18H2,1-6H3,(H,37,43)(H,38,50)(H,39,48)(H,40,52)(H,41,49)(H,42,51)(H,44,45)(H,46,47)(H,53,54)/t20-,23-,24+,25+,26+,27+,30+/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 500n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding constant against hepatitis C virus (HCV) protease

J Med Chem 46: 5360-4 (2003)


Article DOI: 10.1021/jm030040o
BindingDB Entry DOI: 10.7270/Q20001J6
More data for this
Ligand-Target Pair