BindingDB logo
myBDB logout

BDBM260393 US9527838, 21

SMILES: Cn1cnnc1Sc1ccc(Sc2ccc(F)cc2)c(n1)C(=O)Nc1ncc(SCC(C)(C)C(O)=O)s1

InChI Key: InChIKey=RSNUUWYMMBJNKF-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 = 260393   
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
FLAG-Glucokinase (GK)


(Homo sapiens (Human))
BDBM260393
PNG
(US9527838, 21)
Show SMILES Cn1cnnc1Sc1ccc(Sc2ccc(F)cc2)c(n1)C(=O)Nc1ncc(SCC(C)(C)C(O)=O)s1
Show InChI InChI=1S/C23H21FN6O3S4/c1-23(2,20(32)33)11-34-17-10-25-21(37-17)28-19(31)18-15(35-14-6-4-13(24)5-7-14)8-9-16(27-18)36-22-29-26-12-30(22)3/h4-10,12H,11H2,1-3H3,(H,32,33)(H,25,28,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 17.2n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Recombinant human liver glucokinase was expressed as a FLAG fusion protein in E. coli, and purified on ANTIFLAG M2 AFFINITY GEL (Sigma). The assay wa...


US Patent US9527838 (2016)


BindingDB Entry DOI: 10.7270/Q2RV0MN1
More data for this
Ligand-Target Pair