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SMILES: O=C(Cc1cccs1)Nc1nnc(s1)-c1ccncc1

InChI Key: InChIKey=PQXSZIBWQDBEPD-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 = 37913   
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
Rho-associated protein kinase 2


(Homo sapiens (Human))
BDBM37913
PNG
(MLS000065710 | N-(5-pyridin-4-yl-1,3,4-thiadiazol-...)
Show SMILES O=C(Cc1cccs1)Nc1nnc(s1)-c1ccncc1
Show InChI InChI=1S/C13H10N4OS2/c18-11(8-10-2-1-7-19-10)15-13-17-16-12(20-13)9-3-5-14-6-4-9/h1-7H,8H2,(H,15,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.13E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2F769ZM
More data for this
Ligand-Target Pair
cAMP-dependent protein kinase catalytic subunit alpha


(Homo sapiens (Human))
BDBM37913
PNG
(MLS000065710 | N-(5-pyridin-4-yl-1,3,4-thiadiazol-...)
Show SMILES O=C(Cc1cccs1)Nc1nnc(s1)-c1ccncc1
Show InChI InChI=1S/C13H10N4OS2/c18-11(8-10-2-1-7-19-10)15-13-17-16-12(20-13)9-3-5-14-6-4-9/h1-7H,8H2,(H,15,17,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.76E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q24X565S
More data for this
Ligand-Target Pair