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BDBM74483 MLS000702197::N-[2-(carbethoxycarbamoyl)-3-(p-toluidino)acryloyl]carbamic acid ethyl ester::N-[2-[(ethoxycarbonylamino)-oxomethyl]-3-(4-methylanilino)-1-oxoprop-2-enyl]carbamic acid ethyl ester::SMR000226743::cid_1815359::ethyl 2-{[(ethoxycarbonyl)amino]carbonyl}-3-(4-toluidino)acryloylcarbamate::ethyl N-[2-(ethoxycarbonylcarbamoyl)-3-(4-methylanilino)prop-2-enoyl]carbamate::ethyl N-[2-(ethoxycarbonylcarbamoyl)-3-[(4-methylphenyl)amino]prop-2-enoyl]carbamate

SMILES: CCOC(=O)NC(=O)C(C=Nc1ccc(C)cc1)C(=O)NC(=O)OCC

InChI Key: InChIKey=PZPDXMBTOJGXJH-UHFFFAOYSA-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 = 74483   
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))
BDBM74483
PNG
(MLS000702197 | N-[2-(carbethoxycarbamoyl)-3-(p-tol...)
Show SMILES CCOC(=O)NC(=O)C(C=Nc1ccc(C)cc1)C(=O)NC(=O)OCC |w:10.10|
Show InChI InChI=1S/C17H21N3O6/c1-4-25-16(23)19-14(21)13(15(22)20-17(24)26-5-2)10-18-12-8-6-11(3)7-9-12/h6-10,13H,4-5H2,1-3H3,(H,19,21,23)(H,20,22,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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))
BDBM74483
PNG
(MLS000702197 | N-[2-(carbethoxycarbamoyl)-3-(p-tol...)
Show SMILES CCOC(=O)NC(=O)C(C=Nc1ccc(C)cc1)C(=O)NC(=O)OCC |w:10.10|
Show InChI InChI=1S/C17H21N3O6/c1-4-25-16(23)19-14(21)13(15(22)20-17(24)26-5-2)10-18-12-8-6-11(3)7-9-12/h6-10,13H,4-5H2,1-3H3,(H,19,21,23)(H,20,22,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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))
BDBM74483
PNG
(MLS000702197 | N-[2-(carbethoxycarbamoyl)-3-(p-tol...)
Show SMILES CCOC(=O)NC(=O)C(C=Nc1ccc(C)cc1)C(=O)NC(=O)OCC |w:10.10|
Show InChI InChI=1S/C17H21N3O6/c1-4-25-16(23)19-14(21)13(15(22)20-17(24)26-5-2)10-18-12-8-6-11(3)7-9-12/h6-10,13H,4-5H2,1-3H3,(H,19,21,23)(H,20,22,24)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
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