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BDBM484693 US10934297, Compound 86

SMILES: FC(F)Oc1ccc(NC(=O)c2n[nH]c3ccc(cc23)-c2cnn(c2)C2CNC2)cn1

InChI Key: InChIKey=MAPYOBVMOCMQPR-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 484693   
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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM484693
PNG
(US10934297, Compound 86)
Show SMILES FC(F)Oc1ccc(NC(=O)c2n[nH]c3ccc(cc23)-c2cnn(c2)C2CNC2)cn1
Show InChI InChI=1S/C20H17F2N7O2/c21-20(22)31-17-4-2-13(7-24-17)26-19(30)18-15-5-11(1-3-16(15)27-28-18)12-6-25-29(10-12)14-8-23-9-14/h1-7,10,14,20,23H,8-9H2,(H,26,30)(H,27,28)
PDB
MMDB

NCI pathway
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 354n/an/an/an/a



Samumed, LLC

US Patent


Assay Description
GSK3β: Each compound is dissolved in DMSO as a 10 mM stock and used to prepare compound source plates. Serial dilution (1:3, 11-point dose-respo...


US Patent US10934297 (2021)

More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM484693
PNG
(US10934297, Compound 86)
Show SMILES FC(F)Oc1ccc(NC(=O)c2n[nH]c3ccc(cc23)-c2cnn(c2)C2CNC2)cn1
Show InChI InChI=1S/C20H17F2N7O2/c21-20(22)31-17-4-2-13(7-24-17)26-19(30)18-15-5-11(1-3-16(15)27-28-18)12-6-25-29(10-12)14-8-23-9-14/h1-7,10,14,20,23H,8-9H2,(H,26,30)(H,27,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 98n/an/an/an/a



Samumed, LLC

US Patent


Assay Description
DYRK1A: Each compound was dissolved in DMSO as a 10 mM stock and used to prepare compound source plates. Serial dilution (1:3, 11-point dose-response...


US Patent US10934297 (2021)

More data for this
Ligand-Target Pair