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BDBM46193 1-[2,3-bis(2-furanyl)-6-quinoxalinyl]-3-butylurea::1-[2,3-bis(2-furyl)quinoxalin-6-yl]-3-butyl-urea::1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-butyl-urea::1-[2,3-bis(furan-2-yl)quinoxalin-6-yl]-3-butylurea::MLS-0292129.0001::cid_24178227

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

InChI Key: InChIKey=ILELEONWYWOIOY-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 = 46193   
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))
BDBM46193
PNG
(1-[2,3-bis(2-furanyl)-6-quinoxalinyl]-3-butylurea ...)
Show SMILES CCCCNC(=O)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C21H20N4O3/c1-2-3-10-22-21(26)23-14-8-9-15-16(13-14)25-20(18-7-5-12-28-18)19(24-15)17-6-4-11-27-17/h4-9,11-13H,2-3,10H2,1H3,(H2,22,23,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 452n/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...


Citation and Details
More data for this
Ligand-Target Pair
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM46193
PNG
(1-[2,3-bis(2-furanyl)-6-quinoxalinyl]-3-butylurea ...)
Show SMILES CCCCNC(=O)Nc1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C21H20N4O3/c1-2-3-10-22-21(26)23-14-8-9-15-16(13-14)25-20(18-7-5-12-28-18)19(24-15)17-6-4-11-27-17/h4-9,11-13H,2-3,10H2,1H3,(H2,22,23,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 966n/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...


Citation and Details
More data for this
Ligand-Target Pair