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SMILES: CNC(=O)c1n(nc2cc(N(CCCNC(=O)c3cccnc3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(Br)cc1

InChI Key: InChIKey=DPLBSVCORAUCFV-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 103276   
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
Genome polyprotein


(Hepatitis C virus genotype 3a (isolate NZL1) (HCV))
BDBM103276
PNG
(US8546389, 191)
Show SMILES CNC(=O)c1n(nc2cc(N(CCCNC(=O)c3cccnc3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(Br)cc1
Show InChI InChI=1S/C28H29BrN6O4S/c1-30-28(37)26-23-15-22(18-6-7-18)25(16-24(23)33-35(26)21-10-8-20(29)9-11-21)34(40(2,38)39)14-4-13-32-27(36)19-5-3-12-31-17-19/h3,5,8-12,15-18H,4,6-7,13-14H2,1-2H3,(H,30,37)(H,32,36)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 20n/an/an/an/an/an/a



Biota Scientific Management Pty Ltd.

US Patent


Assay Description
HCV polymerase inhibition assay: HCV polymerase reactions were carried out using a modified mothod of Howe et al., Antimicrobial Agents and Chemothe...


US Patent US8546389 (2013)


BindingDB Entry DOI: 10.7270/Q2DZ06XK
More data for this
Ligand-Target Pair
Genome polyprotein


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM103276
PNG
(US8546389, 191)
Show SMILES CNC(=O)c1n(nc2cc(N(CCCNC(=O)c3cccnc3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(Br)cc1
Show InChI InChI=1S/C28H29BrN6O4S/c1-30-28(37)26-23-15-22(18-6-7-18)25(16-24(23)33-35(26)21-10-8-20(29)9-11-21)34(40(2,38)39)14-4-13-32-27(36)19-5-3-12-31-17-19/h3,5,8-12,15-18H,4,6-7,13-14H2,1-2H3,(H,30,37)(H,32,36)
PDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 430n/an/an/an/an/an/a



Biota Scientific Management Pty Ltd.

US Patent


Assay Description
HCV polymerase inhibition assay: HCV polymerase reactions were carried out using a modified mothod of Howe et al., Antimicrobial Agents and Chemothe...


US Patent US8546389 (2013)


BindingDB Entry DOI: 10.7270/Q2DZ06XK
More data for this
Ligand-Target Pair