BindingDB logo
myBDB logout

BDBM260379 US9527838, 7

SMILES: COC(=O)CCc1cnc(NC(=O)c2nc(Sc3nncn3C)ccc2Sc2ccc(OC)cc2)s1

InChI Key: InChIKey=JXMKIBSEIHMSEM-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 = 260379   
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))
BDBM260379
PNG
(US9527838, 7)
Show SMILES COC(=O)CCc1cnc(NC(=O)c2nc(Sc3nncn3C)ccc2Sc2ccc(OC)cc2)s1
Show InChI InChI=1S/C23H22N6O4S3/c1-29-13-25-28-23(29)36-18-10-9-17(34-15-6-4-14(32-2)5-7-15)20(26-18)21(31)27-22-24-12-16(35-22)8-11-19(30)33-3/h4-7,9-10,12-13H,8,11H2,1-3H3,(H,24,27,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 23.4n/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