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BDBM43373 (5-Cyano-4-oxo-2-phenyl-3,4-dihydro-2H-[1,3]thiazin-6-ylsulfanyl)-acetic acid methyl ester::2-[(5-cyano-4-keto-2-phenyl-2,3-dihydro-1,3-thiazin-6-yl)thio]acetic acid methyl ester::2-[(5-cyano-4-oxo-2-phenyl-2,3-dihydro-1,3-thiazin-6-yl)thio]acetic acid methyl ester::MLS000556400::SMR000147717::cid_3512464::methyl 2-[(5-cyano-4-oxidanylidene-2-phenyl-2,3-dihydro-1,3-thiazin-6-yl)sulfanyl]ethanoate::methyl 2-[(5-cyano-4-oxo-2-phenyl-2,3-dihydro-1,3-thiazin-6-yl)sulfanyl]acetate

SMILES: COC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccccc1

InChI Key: InChIKey=BMVMKTNMDRHJOF-UHFFFAOYSA-N

Data: 3 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 = 43373   
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
MDM2-MDMX


(Homo sapiens (Human))
BDBM43373
PNG
((5-Cyano-4-oxo-2-phenyl-3,4-dihydro-2H-[1,3]thiazi...)
Show SMILES COC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccccc1 |c:6|
Show InChI InChI=1S/C14H12N2O3S2/c1-19-11(17)8-20-14-10(7-15)12(18)16-13(21-14)9-5-3-2-4-6-9/h2-6,13H,8H2,1H3,(H,16,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 2.15E+3n/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q21J984Z
More data for this
Ligand-Target Pair
MDM2-MDMX


(Homo sapiens (Human))
BDBM43373
PNG
((5-Cyano-4-oxo-2-phenyl-3,4-dihydro-2H-[1,3]thiazi...)
Show SMILES COC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccccc1 |c:6|
Show InChI InChI=1S/C14H12N2O3S2/c1-19-11(17)8-20-14-10(7-15)12(18)16-13(21-14)9-5-3-2-4-6-9/h2-6,13H,8H2,1H3,(H,16,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 5.00E+3n/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2G73C3D
More data for this
Ligand-Target Pair
MDM2-MDMX


(Homo sapiens (Human))
BDBM43373
PNG
((5-Cyano-4-oxo-2-phenyl-3,4-dihydro-2H-[1,3]thiazi...)
Show SMILES COC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccccc1 |c:6|
Show InChI InChI=1S/C14H12N2O3S2/c1-19-11(17)8-20-14-10(7-15)12(18)16-13(21-14)9-5-3-2-4-6-9/h2-6,13H,8H2,1H3,(H,16,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 4.10E+3n/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2KW5DG0
More data for this
Ligand-Target Pair