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BDBM298580 US10125111, Compound 6002

SMILES: CNC(=O)c1c(oc2cc(N(C(F)F)S(C)(=O)=O)c(cc12)-c1cccc(c1)C(O)=O)-c1ccc(F)cc1

InChI Key: InChIKey=BEKSDDHOFHJFRR-UHFFFAOYSA-N

Data: 1 EC50

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 1 hit for monomerid = 298580   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
RNA polymerase (NS5B)


(Hepatitis C virus (HCV))
BDBM298580
PNG
(US10125111, Compound 6002)
Show SMILES CNC(=O)c1c(oc2cc(N(C(F)F)S(C)(=O)=O)c(cc12)-c1cccc(c1)C(O)=O)-c1ccc(F)cc1
Show InChI InChI=1S/C25H19F3N2O6S/c1-29-23(31)21-18-11-17(14-4-3-5-15(10-14)24(32)33)19(30(25(27)28)37(2,34)35)12-20(18)36-22(21)13-6-8-16(26)9-7-13/h3-12,25H,1-2H3,(H,29,31)(H,32,33)
PDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a>1.00E+4n/an/an/an/a



Bristol-Myers Squibb Co.

US Patent


Assay Description
To evaluate compound efficacy, titrated compounds were transferred to sterile 384-well tissue culture treated plates, and the plates were seeded with...


US Patent US10125111 (2018)


BindingDB Entry DOI: 10.7270/Q2PC34GP
More data for this
Ligand-Target Pair