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BDBM74489 (E)-N-(diallylthiocarbamoyl)-3-(p-tolyl)acrylamide::(E)-N-[[bis(prop-2-enyl)amino]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide::(E)-N-[bis(prop-2-enyl)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide::MLS000701542::N,N-diallyl-N'-[3-(4-methylphenyl)acryloyl]thiourea::SMR000228828::cid_1791998

SMILES: Cc1ccc(\C=C\C(=O)NC(=S)N(CC=C)CC=C)cc1

InChI Key: InChIKey=MELBMOMKPQNPKC-ZHACJKMWSA-N

Data: 3 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 3 hits for monomerid = 74489   
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-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74489
PNG
((E)-N-(diallylthiocarbamoyl)-3-(p-tolyl)acrylamide...)
Show SMILES Cc1ccc(\C=C\C(=O)NC(=S)N(CC=C)CC=C)cc1
Show InChI InChI=1S/C17H20N2OS/c1-4-12-19(13-5-2)17(21)18-16(20)11-10-15-8-6-14(3)7-9-15/h4-11H,1-2,12-13H2,3H3,(H,18,20,21)/b11-10+
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/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 (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24748BK
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74489
PNG
((E)-N-(diallylthiocarbamoyl)-3-(p-tolyl)acrylamide...)
Show SMILES Cc1ccc(\C=C\C(=O)NC(=S)N(CC=C)CC=C)cc1
Show InChI InChI=1S/C17H20N2OS/c1-4-12-19(13-5-2)17(21)18-16(20)11-10-15-8-6-14(3)7-9-15/h4-11H,1-2,12-13H2,3H3,(H,18,20,21)/b11-10+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/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 (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RTC
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 7


(Homo sapiens (Human))
BDBM74489
PNG
((E)-N-(diallylthiocarbamoyl)-3-(p-tolyl)acrylamide...)
Show SMILES Cc1ccc(\C=C\C(=O)NC(=S)N(CC=C)CC=C)cc1
Show InChI InChI=1S/C17H20N2OS/c1-4-12-19(13-5-2)17(21)18-16(20)11-10-15-8-6-14(3)7-9-15/h4-11H,1-2,12-13H2,3H3,(H,18,20,21)/b11-10+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/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 (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2VQ314Z
More data for this
Ligand-Target Pair