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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Capsid scaffolding protein' and Ligand = 'BDBM50288079'   
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
Capsid scaffolding protein


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)		BDBM50288079
PNG
(CHEMBL79521 | {(S)-1-[7-(2-Benzyloxycarbonylamino-...)
Show SMILES CC(NC(=O)OCc1ccccc1)C(=O)Nc1ccc2c(c1)nc(oc2=O)[C@H](C)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C29H28N4O7/c1-18(30-28(36)38-16-20-9-5-3-6-10-20)25(34)32-22-13-14-23-24(15-22)33-26(40-27(23)35)19(2)31-29(37)39-17-21-11-7-4-8-12-21/h3-15,18-19H,16-17H2,1-2H3,(H,30,36)(H,31,37)(H,32,34)/t18?,19-/m0/s1
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PC cid
PC sid
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Similars
Article
n/an/a 1.20E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against herpes simplex type 1 protease (HSV-1 pr).

Bioorg Med Chem Lett 6: 2463-2466 (1996)


Article DOI: 10.1016/0960-894X(96)00455-6
BindingDB Entry DOI: 10.7270/Q2F47P4R
More data for this
Ligand-Target Pair