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BDBM61728 MLS000830182::N-(4-ketothieno[3,2-d][1,3]thiazin-2-yl)-2-furamide::N-(4-oxidanylidenethieno[3,2-d][1,3]thiazin-2-yl)furan-2-carboxamide::N-(4-oxo-2-thieno[3,2-d][1,3]thiazinyl)-2-furancarboxamide::N-(4-oxo-4H-thieno[3,2-d][1,3]thiazin-2-yl)-2-furamide::N-(4-oxothieno[3,2-d][1,3]thiazin-2-yl)furan-2-carboxamide::SMR000458103::cid_2810061

SMILES: O=C(Nc1nc2ccsc2c(=O)s1)c1ccco1

InChI Key: InChIKey=VFHPAWYPWGGPTF-UHFFFAOYSA-N

Data: 1 IC50  2 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 = 61728   
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
Voltage-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))
BDBM61728
PNG
(MLS000830182 | N-(4-ketothieno[3,2-d][1,3]thiazin-...)
Show SMILES O=C(Nc1nc2ccsc2c(=O)s1)c1ccco1
Show InChI InChI=1S/C11H6N2O3S2/c14-9(7-2-1-4-16-7)13-11-12-6-3-5-17-8(6)10(15)18-11/h1-5H,(H,12,13,14)
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.18E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2PZ578V
More data for this
Ligand-Target Pair
Apoptotic peptidase activating factor 1


(Homo sapiens (Human))
BDBM61728
PNG
(MLS000830182 | N-(4-ketothieno[3,2-d][1,3]thiazin-...)
Show SMILES O=C(Nc1nc2ccsc2c(=O)s1)c1ccco1
Show InChI InChI=1S/C11H6N2O3S2/c14-9(7-2-1-4-16-7)13-11-12-6-3-5-17-8(6)10(15)18-11/h1-5H,(H,12,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 2.28E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q29C6VXX
More data for this
Ligand-Target Pair
Apoptotic peptidase activating factor 1


(Homo sapiens (Human))
BDBM61728
PNG
(MLS000830182 | N-(4-ketothieno[3,2-d][1,3]thiazin-...)
Show SMILES O=C(Nc1nc2ccsc2c(=O)s1)c1ccco1
Show InChI InChI=1S/C11H6N2O3S2/c14-9(7-2-1-4-16-7)13-11-12-6-3-5-17-8(6)10(15)18-11/h1-5H,(H,12,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>1.00E+5n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2SB447H
More data for this
Ligand-Target Pair