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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein/Non-structural protein 4A' and Ligand = 'BDBM50537567'   
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/Non-structural protein 4A


(Hepatitis C virus)		BDBM50537567
PNG
(CHEMBL4632418)
Show SMILES COc1ccc2cc(O[C@@H]3C[C@H](N(C3)C(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)C3CCCCC3)C(C)C)C(=O)NC3(CC3)C(O)=O)cnc2c1 |r|
Show InChI InChI=1S/C34H45N5O8/c1-19(2)28(37-31(42)29(36-20(3)40)21-8-6-5-7-9-21)32(43)39-18-25(16-27(39)30(41)38-34(12-13-34)33(44)45)47-24-14-22-10-11-23(46-4)15-26(22)35-17-24/h10-11,14-15,17,19,21,25,27-29H,5-9,12-13,16,18H2,1-4H3,(H,36,40)(H,37,42)(H,38,41)(H,44,45)/t25-,27+,28+,29+/m1/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 800n/an/an/an/an/an/a



Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Inhibition of Epidermal growth factor receptor autophosphorylation in A431 human epidermoid carcinoma cells

Eur J Med Chem 164: 576-601 (2019)


Article DOI: 10.1016/j.ejmech.2018.12.045
BindingDB Entry DOI: 10.7270/Q2RR224D
More data for this
Ligand-Target Pair