BindingDB logo
myBDB logout

BDBM195445 US9670212, 60 3-amino-N-({8-methyl-2-[4-(1H-1,2,3-triazol-1-ylacetyl)-1,4-diazepan-1-yl]quinolin-3-yl}methyl)pyrazine-2-carboxamide

SMILES: Cc1cccc2cc(CNC(=O)c3nccnc3N)c(nc12)N1CCCN(CC1)C(=O)Cn1ccnn1

InChI Key: InChIKey=PWCIQOJXJWXKSF-UHFFFAOYSA-N

Data: 1 IC50

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 = 195445   
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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM195445
PNG
(US9670212, 60 3-amino-N-({8-methyl-2-[4-(1H-1,2,3-...)
Show SMILES Cc1cccc2cc(CNC(=O)c3nccnc3N)c(nc12)N1CCCN(CC1)C(=O)Cn1ccnn1
Show InChI InChI=1S/C25H28N10O2/c1-17-4-2-5-18-14-19(15-29-25(37)22-23(26)28-7-6-27-22)24(31-21(17)18)34-10-3-9-33(12-13-34)20(36)16-35-11-8-30-32-35/h2,4-8,11,14H,3,9-10,12-13,15-16H2,1H3,(H2,26,28)(H,29,37)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 375n/an/an/an/an/an/a



Exelixis Inc

US Patent


Assay Description
Kinase activity is measured as the percent of ATP consumed following the kinase reaction using luciferase-luciferin-coupled chemiluminescence. Reacti...


US Patent US9670212 (2017)


BindingDB Entry DOI: 10.7270/Q27H1GR0
More data for this
Ligand-Target Pair