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BDBM46202 3-[[2,3-bis(2-furyl)quinoxalin-6-yl]carbamoylamino]propionic acid ethyl ester::3-[[[[2,3-bis(2-furanyl)-6-quinoxalinyl]amino]-oxomethyl]amino]propanoic acid ethyl ester::MLS-0292140.0001::cid_24178237::ethyl 3-[[2,3-bis(furan-2-yl)quinoxalin-6-yl]carbamoylamino]propanoate

SMILES: CCOC(=O)CCNC(=O)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1

InChI Key: InChIKey=LTAAXBLMOJQUQP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 46202   
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
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM46202
PNG
(3-[[2,3-bis(2-furyl)quinoxalin-6-yl]carbamoylamino...)
Show SMILES CCOC(=O)CCNC(=O)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C22H20N4O5/c1-2-29-19(27)9-10-23-22(28)24-14-7-8-15-16(13-14)26-21(18-6-4-12-31-18)20(25-15)17-5-3-11-30-17/h3-8,11-13H,2,9-10H2,1H3,(H2,23,24,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 683n/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 (2009)


BindingDB Entry DOI: 10.7270/Q21N7ZJW
More data for this
Ligand-Target Pair
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM46202
PNG
(3-[[2,3-bis(2-furyl)quinoxalin-6-yl]carbamoylamino...)
Show SMILES CCOC(=O)CCNC(=O)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C22H20N4O5/c1-2-29-19(27)9-10-23-22(28)24-14-7-8-15-16(13-14)26-21(18-6-4-12-31-18)20(25-15)17-5-3-11-30-17/h3-8,11-13H,2,9-10H2,1H3,(H2,23,24,28)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.42E+3n/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 (2009)


BindingDB Entry DOI: 10.7270/Q2474894
More data for this
Ligand-Target Pair