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BDBM340881 3-isopropyl-1-(naphthalen-2-yl)imidazo[1,5- a]pyrazin-8-amine::US10544104, Compound 8::US9765037, Compound 8

SMILES: CC(C)c1nc(-c2ccc3ccccc3c2)c2c(N)nccn12

InChI Key: InChIKey=BUZYGKOYMBGUKX-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 340881   
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
Calmodulin-domain protein kinase 1 (CDPK1)


(Toxoplasma gondii)
BDBM340881
PNG
(3-isopropyl-1-(naphthalen-2-yl)imidazo[1,5- a]pyra...)
Show SMILES CC(C)c1nc(-c2ccc3ccccc3c2)c2c(N)nccn12
Show InChI InChI=1S/C19H18N4/c1-12(2)19-22-16(17-18(20)21-9-10-23(17)19)15-8-7-13-5-3-4-6-14(13)11-15/h3-12H,1-2H3,(H2,20,21)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.80n/an/an/an/an/an/a



University of Washington Through its Center for Commercialization

US Patent


Assay Description
Most known kinase inhibitors bind in the ATP-binding pocket of the active site19,20. These inhibitors exploit many of the same hydrophobic contacts a...


US Patent US9765037 (2017)


BindingDB Entry DOI: 10.7270/Q2B56MVC
More data for this
Ligand-Target Pair
Calmodulin-domain protein kinase 1, putative


(Cryptosporidium parvum (strain Iowa II))
BDBM340881
PNG
(3-isopropyl-1-(naphthalen-2-yl)imidazo[1,5- a]pyra...)
Show SMILES CC(C)c1nc(-c2ccc3ccccc3c2)c2c(N)nccn12
Show InChI InChI=1S/C19H18N4/c1-12(2)19-22-16(17-18(20)21-9-10-23(17)19)15-8-7-13-5-3-4-6-14(13)11-15/h3-12H,1-2H3,(H2,20,21)
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7.80n/an/an/an/an/an/a



UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR CO

US Patent


Assay Description
Inhibition of TgCDPK1 and CpCDPK1 was determined using a luminescent kinase assay which measures ATP depletion in the presence of the Syntide 2 pepti...


US Patent US10544104 (2020)


BindingDB Entry DOI: 10.7270/Q2D79DSF
More data for this
Ligand-Target Pair
Calmodulin-domain protein kinase 1


(Toxoplasma gondii)
BDBM340881
PNG
(3-isopropyl-1-(naphthalen-2-yl)imidazo[1,5- a]pyra...)
Show SMILES CC(C)c1nc(-c2ccc3ccccc3c2)c2c(N)nccn12
Show InChI InChI=1S/C19H18N4/c1-12(2)19-22-16(17-18(20)21-9-10-23(17)19)15-8-7-13-5-3-4-6-14(13)11-15/h3-12H,1-2H3,(H2,20,21)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.80n/an/an/an/an/an/a



UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR CO

US Patent


Assay Description
Inhibition of TgCDPK1 and CpCDPK1 was determined using a luminescent kinase assay which measures ATP depletion in the presence of the Syntide 2 pepti...


US Patent US10544104 (2020)


BindingDB Entry DOI: 10.7270/Q2D79DSF
More data for this
Ligand-Target Pair
Calcium-dependent protein kinase 1 (CDPK1)


(Cryptosporidium parvum)
BDBM340881
PNG
(3-isopropyl-1-(naphthalen-2-yl)imidazo[1,5- a]pyra...)
Show SMILES CC(C)c1nc(-c2ccc3ccccc3c2)c2c(N)nccn12
Show InChI InChI=1S/C19H18N4/c1-12(2)19-22-16(17-18(20)21-9-10-23(17)19)15-8-7-13-5-3-4-6-14(13)11-15/h3-12H,1-2H3,(H2,20,21)
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7.80n/an/an/an/an/an/a



University of Washington Through its Center for Commercialization

US Patent


Assay Description
Two types of enzyme assays were developed to follow TgCDPK1 activity, a radiometric scintillation proximity assay measured the labeled γ-phospha...


US Patent US9765037 (2017)


BindingDB Entry DOI: 10.7270/Q2B56MVC
More data for this
Ligand-Target Pair