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SMILES: CCn1cc(cn1)-c1ccc2[nH]nc(C(=O)Nc3ccc(CN4CCCC4)cc3)c2c1

InChI Key: InChIKey=HNUVZLGSVPFKIL-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 = 484677   
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))
BDBM484677
PNG
(US10934297, Compound 70)
Show SMILES CCn1cc(cn1)-c1ccc2[nH]nc(C(=O)Nc3ccc(CN4CCCC4)cc3)c2c1
Show InChI InChI=1S/C24H26N6O/c1-2-30-16-19(14-25-30)18-7-10-22-21(13-18)23(28-27-22)24(31)26-20-8-5-17(6-9-20)15-29-11-3-4-12-29/h5-10,13-14,16H,2-4,11-12,15H2,1H3,(H,26,31)(H,27,28)
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 25n/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))
BDBM484677
PNG
(US10934297, Compound 70)
Show SMILES CCn1cc(cn1)-c1ccc2[nH]nc(C(=O)Nc3ccc(CN4CCCC4)cc3)c2c1
Show InChI InChI=1S/C24H26N6O/c1-2-30-16-19(14-25-30)18-7-10-22-21(13-18)23(28-27-22)24(31)26-20-8-5-17(6-9-20)15-29-11-3-4-12-29/h5-10,13-14,16H,2-4,11-12,15H2,1H3,(H,26,31)(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 5n/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