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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50455110'   
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 14)		BDBM50455110
PNG
(CHEMBL4203502)
Show SMILES CN1CCCC[C@H](NC(=O)c2cc(C)on2)C(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@@H](CCC1=O)C(=O)C(=O)N1CCC1 |r|
Show InChI InChI=1S/C30H37FN6O7/c1-18-16-24(35-44-18)29(42)33-22-6-3-4-13-36(2)25(38)12-11-21(26(39)30(43)37-14-5-15-37)32-28(41)23(34-27(22)40)17-19-7-9-20(31)10-8-19/h7-10,16,21-23H,3-6,11-15,17H2,1-2H3,(H,32,41)(H,33,42)(H,34,40)/t21-,22-,23-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of Human rhinovirus serotype 14 3C protease preincubated for 1 hr followed by Cys(PT14M)-Ala-Ile-Phe-Gln'Gly-Pro-Asp-Phe(4-NH2)-OH substra...

Bioorg Med Chem Lett 28: 906-909 (2018)


Article DOI: 10.1016/j.bmcl.2018.01.064
BindingDB Entry DOI: 10.7270/Q2TF00Z3
More data for this
Ligand-Target Pair