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BDBM39864 (4-methoxy-7,7-dimethyl-6,8-dihydropyrimido[4,5-b][1,4]benzothiazin-9-yl)amine;hydrobromide::4-methoxy-7,7-dimethyl-6,8-dihydropyrimido[4,5-b][1,4]benzothiazin-9-amine;hydrobromide::MLS000038875::SMR000036340::cid_6602809

SMILES: COc1ncnc2SC3=C(N)CC(C)(C)CC3=Nc12

InChI Key: InChIKey=DNYDSBPAGXPLLN-UHFFFAOYSA-N

Data: 2 IC50  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 3 hits for monomerid = 39864   
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
tyrosine 3-monooxygenase/tryptophan 5-monooxygenase activation protein, gamma polypeptide


(Homo sapiens (Human))
BDBM39864
PNG
((4-methoxy-7,7-dimethyl-6,8-dihydropyrimido[4,5-b]...)
Show SMILES COc1ncnc2SC3=C(N)CC(C)(C)CC3=Nc12 |c:8,17|
Show InChI InChI=1S/C13H16N4OS/c1-13(2)4-7(14)10-8(5-13)17-9-11(18-3)15-6-16-12(9)19-10/h6H,4-5,14H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.00E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN MLSCN Grant: 1 X01MH78953-01 The 14-3-3 pr...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2V986FT
More data for this
Ligand-Target Pair
cardiac alpha tropomyosin


(Sus scrofa)
BDBM39864
PNG
((4-methoxy-7,7-dimethyl-6,8-dihydropyrimido[4,5-b]...)
Show SMILES COc1ncnc2SC3=C(N)CC(C)(C)CC3=Nc12 |c:8,17|
Show InChI InChI=1S/C13H16N4OS/c1-13(2)4-7(14)10-8(5-13)17-9-11(18-3)15-6-16-12(9)19-10/h6H,4-5,14H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>7.94E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q21N7ZKB
More data for this
Ligand-Target Pair
BZLF2


(Human herpesvirus 4 type 2)
BDBM39864
PNG
((4-methoxy-7,7-dimethyl-6,8-dihydropyrimido[4,5-b]...)
Show SMILES COc1ncnc2SC3=C(N)CC(C)(C)CC3=Nc12 |c:8,17|
Show InChI InChI=1S/C13H16N4OS/c1-13(2)4-7(14)10-8(5-13)17-9-11(18-3)15-6-16-12(9)19-10/h6H,4-5,14H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.09E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair